CAS RN: 4789-67-7
CAS Name: (Z)-2-butenedioic acid; 1-(2-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine
OPENEYE Name: 1-(2-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; 1-(2-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 1-(2-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine
MOLECULAR FORMULA: C23H25ClN2O4S
MOLECULAR WEIGHT: 460.9736
SMILES: CN1CCN(CC1)C2CC3=CC=CC=C3SC4=C2C=CC(=C4)Cl.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 4789-66-6
CAS Name: (Z)-2-butenedioic acid; 1-(1-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine
OPENEYE Name: 1-(1-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; 1-(1-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methylpiperazine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 1-(1-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-methyl-piperazine
MOLECULAR FORMULA: C23H25ClN2O4S
MOLECULAR WEIGHT: 460.9736
SMILES: CN1CCN(CC1)C2CC3=CC=CC=C3SC4=C2C=CC=C4Cl.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 4789-64-4
CAS Name: (Z)-2-butenedioic acid; 1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methylpiperazine
OPENEYE Name: 1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methyl-piperazine; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; 1-(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methylpiperazine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 1-(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)-4-methyl-piperazine
MOLECULAR FORMULA: C23H25ClN2O4S
MOLECULAR WEIGHT: 460.9736
SMILES: CN1CCN(CC1)C2CC3=C(C=CC(=C3)Cl)SC4=CC=CC=C24.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 4789-62-2
CAS Name: (E)-2-butenedioic acid; 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-ethylpiperazine
OPENEYE Name: 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-ethyl-piperazine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-ethylpiperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-4-ethyl-piperazine
MOLECULAR FORMULA: C24H28N2O4S
MOLECULAR WEIGHT: 440.55512
SMILES: CCN1CCN(CC1)C2CC3=CC=CC=C3SC4=CC=CC=C24.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 4789-54-2
CAS Name: (Z)-2-butenedioic acid; 2-[(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)oxy]-N,N-dimethylethanamine
OPENEYE Name: 2-[(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)oxy]-N,N-dimethyl-ethanamine; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; 2-[(3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)oxy]-N,N-dimethylethanamine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; 2-[(3-chloranyl-5,6-dihydrobenzo[b][1]benzothiepin-6-yl)oxy]-N,N-dimethyl-ethanamine
MOLECULAR FORMULA: C22H24ClNO5S
MOLECULAR WEIGHT: 449.94766
SMILES: CN(C)CCOC1CC2=C(C=CC(=C2)Cl)SC3=CC=CC=C13.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 4789-51-9
CAS Name: (E)-2-butenedioic acid; 1-(5,6-dihydrobenzo[b][1]benzoxepin-5-yl)-4-methylpiperazine
OPENEYE Name: 1-(5,6-dihydrobenzo[b][1]benzoxepin-5-yl)-4-methyl-piperazine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 1-(5,6-dihydrobenzo[b][1]benzoxepin-5-yl)-4-methylpiperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-(5,6-dihydrobenzo[b][1]benzoxepin-5-yl)-4-methyl-piperazine
MOLECULAR FORMULA: C23H26N2O5
MOLECULAR WEIGHT: 410.46294
SMILES: CN1CCN(CC1)C2CC3=CC=CC=C3OC4=CC=CC=C24.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 4777-44-0
CAS Name: (E)-2-butenedioic acid; 6-chloro-3-[3-(4-phenyl-1-piperazinyl)propyl]-1H-quinazoline-2,4-dione
OPENEYE Name: 6-chloro-3-[3-(4-phenylpiperazin-1-yl)propyl]-1H-quinazoline-2,4-dione; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 6-chloro-3-[3-(4-phenylpiperazin-1-yl)propyl]-1H-quinazoline-2,4-dione
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 6-chloranyl-3-[3-(4-phenylpiperazin-1-yl)propyl]-1H-quinazoline-2,4-dione
MOLECULAR FORMULA: C25H27ClN4O6
MOLECULAR WEIGHT: 514.95808
SMILES: C1CN(CCN1CCCN2C(=O)C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 4774-30-5
CAS Name: (E)-2-butenedioic acid; 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
OPENEYE Name: 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine; fumaric acid
IUPAC Name: (E)-but-2-enedioic acid; 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
MOLECULAR FORMULA: C22H24N2O4S
MOLECULAR WEIGHT: 412.50196
SMILES: C1CN(CCN1)C2CC3=CC=CC=C3SC4=CC=CC=C24.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 4774-28-1
CAS Name: (Z)-2-butenedioic acid; 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-piperazinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine-1-carboxylate; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; ethyl 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine-1-carboxylate
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; ethyl 4-(5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine-1-carboxylate
MOLECULAR FORMULA: C25H28N2O6S
MOLECULAR WEIGHT: 484.56462
SMILES: CCOC(=O)N1CCN(CC1)C2CC3=CC=CC=C3SC4=CC=CC=C24.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 4750-94-1
CAS Name: (Z)-2-butenedioic acid; N,2-dimethyl-3,3-diphenyl-N-(2-phenylethyl)-2-propen-1-amine
OPENEYE Name: N,2-dimethyl-3,3-diphenyl-N-(2-phenylethyl)prop-2-en-1-amine; maleic acid
IUPAC Name: (Z)-but-2-enedioic acid; N,2-dimethyl-3,3-diphenyl-N-(2-phenylethyl)prop-2-en-1-amine
SYSTEMATIC NAME: (Z)-but-2-enedioic acid; N,2-dimethyl-3,3-diphenyl-N-(2-phenylethyl)prop-2-en-1-amine
MOLECULAR FORMULA: C29H31NO4
MOLECULAR WEIGHT: 457.56074
SMILES: CC(=C(C1=CC=CC=C1)C2=CC=CC=C2)CN(C)CCC3=CC=CC=C3.C(=C\C(=O)O)\C(=O)O
Structure:
CAS RN: 4634-22-4
CAS Name: N,N-diethyl-2-[(E)-2-(1-naphthalenyl)hex-4-enoxy]ethanamine
OPENEYE Name: N,N-diethyl-2-[(E)-2-(1-naphthyl)hex-4-enoxy]ethanamine
IUPAC Name: N,N-diethyl-2-[(E)-2-naphthalen-1-ylhex-4-enoxy]ethanamine
SYSTEMATIC NAME: N,N-diethyl-2-[(E)-2-naphthalen-1-ylhex-4-enoxy]ethanamine
MOLECULAR FORMULA: C22H31NO
MOLECULAR WEIGHT: 325.48764
SMILES: CCN(CC)CCOCC(C/C=C/C)C1=CC=CC2=CC=CC=C21
Structure:
CAS RN: 4544-82-5
CAS Name: (E)-3-(5-nitro-2-furanyl)-1-(4-nitrophenyl)-2-propen-1-one
OPENEYE Name: (E)-3-(5-nitro-2-furyl)-1-(4-nitrophenyl)prop-2-en-1-one
IUPAC Name: (E)-3-(5-nitrofuran-2-yl)-1-(4-nitrophenyl)prop-2-en-1-one
SYSTEMATIC NAME: (E)-3-(5-nitrofuran-2-yl)-1-(4-nitrophenyl)prop-2-en-1-one
MOLECULAR FORMULA: C13H8N2O6
MOLECULAR WEIGHT: 288.21242
SMILES: C1=CC(=CC=C1C(=O)/C=C/C2=CC=C(O2)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 4480-22-2
CAS Name: (E)-3-(3-pyridinyl)-2-propenoic acid 2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl ester
OPENEYE Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl (E)-3-(3-pyridyl)prop-2-enoate
IUPAC Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl (E)-3-pyridin-3-ylprop-2-enoate
SYSTEMATIC NAME: 2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl (E)-3-pyridin-3-ylprop-2-enoate
MOLECULAR FORMULA: C21H25N3O3
MOLECULAR WEIGHT: 367.4415
SMILES: COC1=CC=C(C=C1)N2CCN(CC2)CCOC(=O)/C=C/C3=CN=CC=C3
Structure:
CAS RN: 4464-33-9
CAS Name: 1-[(1Z,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-methoxybenzene
OPENEYE Name: 1-[(1Z,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-methoxy-benzene
IUPAC Name: 1-[(1Z,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-methoxybenzene
SYSTEMATIC NAME: 1-[(1Z,3Z)-2,3-diisocyano-4-(4-methoxyphenyl)buta-1,3-dienyl]-4-methoxy-benzene
MOLECULAR FORMULA: C20H16N2O2
MOLECULAR WEIGHT: 316.35324
SMILES: COC1=CC=C(C=C1)/C=C(\[N+]#[C-])/C(=C/C2=CC=C(C=C2)OC)/[N+]#[C-]
Structure:
CAS RN: 4415-62-7
CAS Name: (E)-3-thiophen-2-yl-2-propenoic acid 2-[4-(4-chlorophenyl)-1-piperazinyl]ethyl ester
OPENEYE Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]ethyl (E)-3-(2-thienyl)prop-2-enoate
IUPAC Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]ethyl (E)-3-thiophen-2-ylprop-2-enoate
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)piperazin-1-yl]ethyl (E)-3-thiophen-2-ylprop-2-enoate
MOLECULAR FORMULA: C19H21ClN2O2S
MOLECULAR WEIGHT: 376.90024
SMILES: C1CN(CCN1CCOC(=O)/C=C/C2=CC=CS2)C3=CC=C(C=C3)Cl
Structure:
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