CAS RN: 19749-63-4
CAS Name: N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(phenylmethyl)-4-thiazolyl]phenyl]iminomethyl]aniline hydrochloride
OPENEYE Name: 4-[[4-(2-benzylthiazol-4-yl)phenyl]iminomethyl]-N,N-bis(2-chloroethyl)-3-methyl-aniline hydrochloride
IUPAC Name: 4-[[4-(2-benzyl-1,3-thiazol-4-yl)phenyl]iminomethyl]-N,N-bis(2-chloroethyl)-3-methylaniline hydrochloride
SYSTEMATIC NAME: N,N-bis(2-chloroethyl)-3-methyl-4-[[4-[2-(phenylmethyl)-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline hydrochloride
MOLECULAR FORMULA: C28H28Cl3N3S
MOLECULAR WEIGHT: 544.96602
SMILES: CC1=C(C=CC(=C1)N(CCCl)CCCl)C=NC2=CC=C(C=C2)C3=CSC(=N3)CC4=CC=CC=C4.Cl
Structure:
CAS RN: 13990-65-3
CAS Name: [4-(2-hydroxypropan-2-yl)phenyl]methyl-trimethylammonium iodide
OPENEYE Name: [4-(1-hydroxy-1-methyl-ethyl)phenyl]methyl-trimethyl-ammonium iodide
IUPAC Name: [4-(2-hydroxypropan-2-yl)phenyl]methyl-trimethylazanium iodide
SYSTEMATIC NAME: trimethyl-[[4-(2-oxidanylpropan-2-yl)phenyl]methyl]azanium iodide
MOLECULAR FORMULA: C13H22INO
MOLECULAR WEIGHT: 335.22435
SMILES: CC(C)(C1=CC=C(C=C1)C[N+](C)(C)C)O.[I-]
Structure:
CAS RN: 29366-94-7
CAS Name: 2-[bis(2-azanidylethyl)amino]ethylazanide; carbonic acid; cobalt(3+)
OPENEYE Name: cobaltic; 2-[bis(2-azanidylethyl)amino]ethylazanide; carbonic acid
IUPAC Name: 2-[bis(2-azanidylethyl)amino]ethylazanide; carbonic acid; cobalt(3+)
SYSTEMATIC NAME: 2-[bis(2-azanidylethyl)amino]ethylazanide; carbonic acid; cobalt(3+)
MOLECULAR FORMULA: C7H17CoN4O3
MOLECULAR WEIGHT: 264.16808
SMILES: C(CN(CC[NH-])CC[NH-])[NH-].C(=O)(O)O.[Co+3]
Structure:
CAS RN: 14878-83-2
CAS Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; carbonic acid; cobalt
OPENEYE Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; carbonic acid; cobalt
IUPAC Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; carbonic acid; cobalt
SYSTEMATIC NAME: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; carbonic acid; cobalt
MOLECULAR FORMULA: C7H16CoN4O3-4
MOLECULAR WEIGHT: 263.16014
SMILES: C(C[N-]CC[N-]CC[NH-])[NH-].C(=O)(O)O.[Co]
Structure:
CAS RN: 23867-05-2
CAS Name: 3-acetylpentane-2,4-dione; chromium
OPENEYE Name: 3-acetylpentane-2,4-dione; chromium
IUPAC Name: 3-acetylpentane-2,4-dione; chromium
SYSTEMATIC NAME: chromium; 3-ethanoylpentane-2,4-dione
MOLECULAR FORMULA: C21H30CrO9
MOLECULAR WEIGHT: 478.4536
SMILES: CC(=O)C(C(=O)C)C(=O)C.CC(=O)C(C(=O)C)C(=O)C.CC(=O)C(C(=O)C)C(=O)C.[Cr]
Structure:
CAS RN: 29086-21-3
CAS Name: 2-[bis(2-azanidylethyl)amino]ethylazanide; cobalt(3+); dinitrite
OPENEYE Name: cobaltic 2-[bis(2-azanidylethyl)amino]ethylazanide dinitrite
IUPAC Name: 2-[bis(2-azanidylethyl)amino]ethylazanide; cobalt(3+); dinitrite
SYSTEMATIC NAME: 2-[bis(2-azanidylethyl)amino]ethylazanide; cobalt(3+); dinitrite
MOLECULAR FORMULA: C6H15CoN6O4-2
MOLECULAR WEIGHT: 294.1543
SMILES: C(CN(CC[NH-])CC[NH-])[NH-].N(=O)[O-].N(=O)[O-].[Co+3]
Structure:
CAS RN: 27883-40-5
CAS Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; cobalt; dinitrite
OPENEYE Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; cobalt; dinitrite
IUPAC Name: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; cobalt; dinitrite
SYSTEMATIC NAME: 2-azanidylethyl-[2-(2-azanidylethylazanidyl)ethyl]azanide; cobalt; dinitrite
MOLECULAR FORMULA: C6H14CoN6O4-6
MOLECULAR WEIGHT: 293.14636
SMILES: C(C[N-]CC[N-]CC[NH-])[NH-].N(=O)[O-].N(=O)[O-].[Co]
Structure:
CAS RN: 66060-25-1
CAS Name: 3-chloropentane-2,4-dione; pentane-2,4-dione; rhodium
OPENEYE Name: 3-chloropentane-2,4-dione; pentane-2,4-dione; rhodium
IUPAC Name: 3-chloropentane-2,4-dione; pentane-2,4-dione; rhodium
SYSTEMATIC NAME: 3-chloranylpentane-2,4-dione; pentane-2,4-dione; rhodium
MOLECULAR FORMULA: C15H22Cl2O6Rh
MOLECULAR WEIGHT: 472.14308
SMILES: CC(=O)CC(=O)C.CC(=O)C(C(=O)C)Cl.CC(=O)C(C(=O)C)Cl.[Rh]
Structure:
CAS RN: 62560-35-4
CAS Name: 3-bromopentane-2,4-dione; rhodium
OPENEYE Name: 3-bromopentane-2,4-dione; rhodium
IUPAC Name: 3-bromopentane-2,4-dione; rhodium
SYSTEMATIC NAME: 3-bromanylpentane-2,4-dione; rhodium
MOLECULAR FORMULA: C15H21Br3O6Rh
MOLECULAR WEIGHT: 639.94114
SMILES: CC(=O)C(C(=O)C)Br.CC(=O)C(C(=O)C)Br.CC(=O)C(C(=O)C)Br.[Rh]
Structure:
CAS RN: 19749-57-6
CAS Name: N,N-bis(2-chloroethyl)-4-[[4-[2-[(4-methoxyphenyl)methyl]-4-thiazolyl]phenyl]iminomethyl]aniline hydrochloride
OPENEYE Name: N,N-bis(2-chloroethyl)-4-[[4-[2-[(4-methoxyphenyl)methyl]thiazol-4-yl]phenyl]iminomethyl]aniline hydrochloride
IUPAC Name: N,N-bis(2-chloroethyl)-4-[[4-[2-[(4-methoxyphenyl)methyl]-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline hydrochloride
SYSTEMATIC NAME: N,N-bis(2-chloroethyl)-4-[[4-[2-[(4-methoxyphenyl)methyl]-1,3-thiazol-4-yl]phenyl]iminomethyl]aniline hydrochloride
MOLECULAR FORMULA: C28H28Cl3N3OS
MOLECULAR WEIGHT: 560.96542
SMILES: COC1=CC=C(C=C1)CC2=NC(=CS2)C3=CC=C(C=C3)N=CC4=CC=C(C=C4)N(CCCl)CCCl.Cl
Structure:
CAS RN: 27420-76-4
CAS Name: N3-[[4-[bis(2-chloroethyl)amino]-3-methoxyphenyl]methylideneamino]-1,2,4-triazole-3,4-diamine hydrochloride
OPENEYE Name: N3-[[4-[bis(2-chloroethyl)amino]-3-methoxy-phenyl]methyleneamino]-1,2,4-triazole-3,4-diamine hydrochloride
IUPAC Name: 3-N-[[4-[bis(2-chloroethyl)amino]-3-methoxyphenyl]methylideneamino]-1,2,4-triazole-3,4-diamine hydrochloride
SYSTEMATIC NAME: N3-[[4-[bis(2-chloroethyl)amino]-3-methoxy-phenyl]methylideneamino]-1,2,4-triazole-3,4-diamine hydrochloride
MOLECULAR FORMULA: C14H20Cl3N7O
MOLECULAR WEIGHT: 408.7139
SMILES: COC1=C(C=CC(=C1)C=NNC2=NN=CN2N)N(CCCl)CCCl.Cl
Structure:
CAS RN: 27466-68-8
CAS Name: N3-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-5-ethyl-1,2,4-triazole-3,4-diamine hydrochloride
OPENEYE Name: N3-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methyleneamino]-5-ethyl-1,2,4-triazole-3,4-diamine hydrochloride
IUPAC Name: 3-N-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-5-ethyl-1,2,4-triazole-3,4-diamine hydrochloride
SYSTEMATIC NAME: N3-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-5-ethyl-1,2,4-triazole-3,4-diamine hydrochloride
MOLECULAR FORMULA: C15H22Cl3N7
MOLECULAR WEIGHT: 406.74108
SMILES: CCC1=NN=C(N1N)N/N=C/C2=CC=C(C=C2)N(CCCl)CCCl.Cl
Structure:
CAS RN: 10547-14-5
CAS Name: N,N-dimethyl-N'-(4-methylphenyl)methanimidamide hydrochloride
OPENEYE Name: N,N-dimethyl-N'-(p-tolyl)formamidine hydrochloride
IUPAC Name: N,N-dimethyl-N'-(4-methylphenyl)methanimidamide hydrochloride
SYSTEMATIC NAME: N,N-dimethyl-N'-(4-methylphenyl)methanimidamide hydrochloride
MOLECULAR FORMULA: C10H15ClN2
MOLECULAR WEIGHT: 198.6925
SMILES: CC1=CC=C(C=C1)N=CN(C)C.Cl
Structure:
CAS RN: 16853-07-9
CAS Name: 4-(phenylmethyl)-1,2,3,5,6,7-hexahydropyrrolizin-4-ium-8-ol perchlorate
OPENEYE Name: 4-benzyl-1,2,3,5,6,7-hexahydropyrrolizin-4-ium-8-ol perchlorate
IUPAC Name: 4-benzyl-1,2,3,5,6,7-hexahydropyrrolizin-4-ium-8-ol perchlorate
SYSTEMATIC NAME: 4-(phenylmethyl)-1,2,3,5,6,7-hexahydropyrrolizin-4-ium-8-ol perchlorate
MOLECULAR FORMULA: C14H20ClNO5
MOLECULAR WEIGHT: 317.7653
SMILES: C1CC2(CCC[N+]2(C1)CC3=CC=CC=C3)O.[O-]Cl(=O)(=O)=O
Structure:
CAS RN: 26866-59-1
CAS Name: 1-methylquinolin-1-ium; 2,4,6-trinitrophenol
OPENEYE Name: 1-methylquinolin-1-ium; picric acid
IUPAC Name: 1-methylquinolin-1-ium; 2,4,6-trinitrophenol
SYSTEMATIC NAME: 1-methylquinolin-1-ium; 2,4,6-trinitrophenol
MOLECULAR FORMULA: C16H13N4O7+
MOLECULAR WEIGHT: 373.29702
SMILES: C[N+]1=CC=CC2=CC=CC=C21.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 4565-10-0
CAS Name: 1,2,2,5-tetramethylpyrrolidine hydrochloride
OPENEYE Name: 1,2,2,5-tetramethylpyrrolidine hydrochloride
IUPAC Name: 1,2,2,5-tetramethylpyrrolidine hydrochloride
SYSTEMATIC NAME: 1,2,2,5-tetramethylpyrrolidine hydrochloride
MOLECULAR FORMULA: C8H18ClN
MOLECULAR WEIGHT: 163.68822
SMILES: CC1CCC(N1C)(C)C.Cl
Structure:
CAS RN: 13472-70-3
CAS Name: sodium 3-methyl-1H-pyridin-2-one
OPENEYE Name: sodium 3-methyl-1H-pyridin-2-one
IUPAC Name: sodium 3-methyl-1H-pyridin-2-one
SYSTEMATIC NAME: sodium 3-methyl-1H-pyridin-2-one
MOLECULAR FORMULA: C6H7NNaO+
MOLECULAR WEIGHT: 132.11565
SMILES: CC1=CC=CNC1=O.[Na+]
Structure:
CAS RN: 13472-73-6
CAS Name: sodium 5-methyl-1H-pyridin-2-one
OPENEYE Name: sodium 5-methyl-1H-pyridin-2-one
IUPAC Name: sodium 5-methyl-1H-pyridin-2-one
SYSTEMATIC NAME: sodium 5-methyl-1H-pyridin-2-one
MOLECULAR FORMULA: C6H7NNaO+
MOLECULAR WEIGHT: 132.11565
SMILES: CC1=CNC(=O)C=C1.[Na+]
Structure:
CAS RN: 20329-57-1
CAS Name: 9-[4-[bis(2-chloroethyl)amino]phenyl]-3H-purine-6-thione hydrochloride
OPENEYE Name: 9-[4-[bis(2-chloroethyl)amino]phenyl]-3H-purine-6-thione hydrochloride
IUPAC Name: 9-[4-[bis(2-chloroethyl)amino]phenyl]-3H-purine-6-thione hydrochloride
SYSTEMATIC NAME: 9-[4-[bis(2-chloroethyl)amino]phenyl]-3H-purine-6-thione hydrochloride
MOLECULAR FORMULA: C15H16Cl3N5S
MOLECULAR WEIGHT: 404.74504
SMILES: C1=CC(=CC=C1N2C=NC3=C2NC=NC3=S)N(CCCl)CCCl.Cl
Structure:
CAS RN: 19112-56-2
CAS Name: 9-[4-[bis(2-chloroethyl)amino]phenyl]-6-purinamine hydrochloride
OPENEYE Name: 9-[4-[bis(2-chloroethyl)amino]phenyl]purin-6-amine hydrochloride
IUPAC Name: 9-[4-[bis(2-chloroethyl)amino]phenyl]purin-6-amine hydrochloride
SYSTEMATIC NAME: 9-[4-[bis(2-chloroethyl)amino]phenyl]purin-6-amine hydrochloride
MOLECULAR FORMULA: C15H17Cl3N6
MOLECULAR WEIGHT: 387.69468
SMILES: C1=CC(=CC=C1N2C=NC3=C2N=CN=C3N)N(CCCl)CCCl.Cl
Structure:
CAS RN: 18204-00-7
CAS Name: N4-[4-[bis(2-chloroethyl)amino]phenyl]-6-chloropyrimidine-4,5-diamine hydrochloride
OPENEYE Name: N4-[4-[bis(2-chloroethyl)amino]phenyl]-6-chloro-pyrimidine-4,5-diamine hydrochloride
IUPAC Name: 4-N-[4-[bis(2-chloroethyl)amino]phenyl]-6-chloropyrimidine-4,5-diamine hydrochloride
SYSTEMATIC NAME: N4-[4-[bis(2-chloroethyl)amino]phenyl]-6-chloranyl-pyrimidine-4,5-diamine hydrochloride
MOLECULAR FORMULA: C14H17Cl4N5
MOLECULAR WEIGHT: 397.13028
SMILES: C1=CC(=CC=C1NC2=C(C(=NC=N2)Cl)N)N(CCCl)CCCl.Cl
Structure:
CAS RN: 37436-93-4
CAS Name: N-(5,6-diamino-4-chloro-2-pyridinyl)carbamic acid ethyl ester hydrochloride
OPENEYE Name: ethyl N-(5,6-diamino-4-chloro-2-pyridyl)carbamate hydrochloride
IUPAC Name: ethyl N-(5,6-diamino-4-chloropyridin-2-yl)carbamate hydrochloride
SYSTEMATIC NAME: ethyl N-[5,6-bis(azanyl)-4-chloranyl-pyridin-2-yl]carbamate hydrochloride
MOLECULAR FORMULA: C8H12Cl2N4O2
MOLECULAR WEIGHT: 267.11248
SMILES: CCOC(=O)NC1=NC(=C(C(=C1)Cl)N)N.Cl
Structure:
CAS RN: 16699-67-5
CAS Name: 2-[bis(2-chloroethyl)amino]-N-(4-methoxyphenyl)acetamide hydrochloride
OPENEYE Name: 2-[bis(2-chloroethyl)amino]-N-(4-methoxyphenyl)acetamide hydrochloride
IUPAC Name: 2-[bis(2-chloroethyl)amino]-N-(4-methoxyphenyl)acetamide hydrochloride
SYSTEMATIC NAME: 2-[bis(2-chloroethyl)amino]-N-(4-methoxyphenyl)ethanamide hydrochloride
MOLECULAR FORMULA: C13H19Cl3N2O2
MOLECULAR WEIGHT: 341.66116
SMILES: COC1=CC=C(C=C1)NC(=O)CN(CCCl)CCCl.Cl
Structure:
CAS RN: 16695-69-5
CAS Name: 2-[bis(2-chloroethyl)amino]-N-(3-fluorophenyl)acetamide hydrochloride
OPENEYE Name: 2-[bis(2-chloroethyl)amino]-N-(3-fluorophenyl)acetamide hydrochloride
IUPAC Name: 2-[bis(2-chloroethyl)amino]-N-(3-fluorophenyl)acetamide hydrochloride
SYSTEMATIC NAME: 2-[bis(2-chloroethyl)amino]-N-(3-fluorophenyl)ethanamide hydrochloride
MOLECULAR FORMULA: C12H16Cl3FN2O
MOLECULAR WEIGHT: 329.625643
SMILES: C1=CC(=CC(=C1)F)NC(=O)CN(CCCl)CCCl.Cl
Structure:
CAS RN: 16695-68-4
CAS Name: 2-[bis(2-chloroethyl)amino]-N-phenylacetamide hydrochloride
OPENEYE Name: 2-[bis(2-chloroethyl)amino]-N-phenyl-acetamide hydrochloride
IUPAC Name: 2-[bis(2-chloroethyl)amino]-N-phenylacetamide hydrochloride
SYSTEMATIC NAME: 2-[bis(2-chloroethyl)amino]-N-phenyl-ethanamide hydrochloride
MOLECULAR FORMULA: C12H17Cl3N2O
MOLECULAR WEIGHT: 311.63518
SMILES: C1=CC=C(C=C1)NC(=O)CN(CCCl)CCCl.Cl
Structure:
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