CAS RN: 42362-28-7
CAS Name: 6-chloro-3-[(2,6-diamino-4-pyrimidinyl)amino]-1H-pyridine-2-thione
OPENEYE Name: 6-chloro-3-[(2,6-diaminopyrimidin-4-yl)amino]-1H-pyridine-2-thione
IUPAC Name: 6-chloro-3-[(2,6-diaminopyrimidin-4-yl)amino]-1H-pyridine-2-thione
SYSTEMATIC NAME: 3-[[2,6-bis(azanyl)pyrimidin-4-yl]amino]-6-chloranyl-1H-pyridine-2-thione
MOLECULAR FORMULA: C9H9ClN6S
MOLECULAR WEIGHT: 268.72596
SMILES: C1=C(C(=S)NC(=C1)Cl)NC2=NC(=NC(=C2)N)N
Structure:
CAS RN: 42362-27-6
CAS Name: 3-[(2,6-diamino-4-pyrimidinyl)amino]-6-methoxy-1H-pyridine-2-thione
OPENEYE Name: 3-[(2,6-diaminopyrimidin-4-yl)amino]-6-methoxy-1H-pyridine-2-thione
IUPAC Name: 3-[(2,6-diaminopyrimidin-4-yl)amino]-6-methoxy-1H-pyridine-2-thione
SYSTEMATIC NAME: 3-[[2,6-bis(azanyl)pyrimidin-4-yl]amino]-6-methoxy-1H-pyridine-2-thione
MOLECULAR FORMULA: C10H12N6OS
MOLECULAR WEIGHT: 264.30688
SMILES: COC1=CC=C(C(=S)N1)NC2=NC(=NC(=C2)N)N
Structure:
CAS RN: 149488-17-5
CAS Name: 1-(5-bromo-2-pyridinyl)-3-[2-(2-pyridinyl)ethyl]thiourea
OPENEYE Name: 1-(5-bromo-2-pyridyl)-3-[2-(2-pyridyl)ethyl]thiourea
IUPAC Name: 1-(5-bromopyridin-2-yl)-3-(2-pyridin-2-ylethyl)thiourea
SYSTEMATIC NAME: 1-(5-bromanylpyridin-2-yl)-3-(2-pyridin-2-ylethyl)thiourea
MOLECULAR FORMULA: C13H13BrN4S
MOLECULAR WEIGHT: 337.23812
SMILES: C1=CC=NC(=C1)CCNC(=S)NC2=NC=C(C=C2)Br
Structure:
CAS RN: 345631-78-9
CAS Name: 3-(3-pyridinyl)-2H-1,2,4-oxadiazole-5-thione
OPENEYE Name: 3-(3-pyridyl)-2H-1,2,4-oxadiazole-5-thione
IUPAC Name: 3-pyridin-3-yl-2H-1,2,4-oxadiazole-5-thione
SYSTEMATIC NAME: 3-pyridin-3-yl-2H-1,2,4-oxadiazole-5-thione
MOLECULAR FORMULA: C7H5N3OS
MOLECULAR WEIGHT: 179.1991
SMILES: C1=CC(=CN=C1)C2=NC(=S)ON2
Structure:
CAS RN: 345631-77-8
CAS Name: 3-pyridin-4-yl-2H-1,2,4-oxadiazole-5-thione
OPENEYE Name: 3-(4-pyridyl)-2H-1,2,4-oxadiazole-5-thione
IUPAC Name: 3-pyridin-4-yl-2H-1,2,4-oxadiazole-5-thione
SYSTEMATIC NAME: 3-pyridin-4-yl-2H-1,2,4-oxadiazole-5-thione
MOLECULAR FORMULA: C7H5N3OS
MOLECULAR WEIGHT: 179.1991
SMILES: C1=CN=CC=C1C2=NC(=S)ON2
Structure:
CAS RN: 257891-73-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H20F3N3S
MOLECULAR WEIGHT: 355.42101
SMILES: CC1CN2C3=C(C=C(C=C3CN1CC=C(C)C)C(F)(F)F)NC2=S
Structure:
CAS RN: 39935-49-4
CAS Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]pyridine-2,4-dione
OPENEYE Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyridine-2,4-dione
IUPAC Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyridine-2,4-dione
SYSTEMATIC NAME: 1-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]pyridine-2,4-dione
MOLECULAR FORMULA: C10H13NO6
MOLECULAR WEIGHT: 243.21332
SMILES: C1C(=O)C=CN(C1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
Structure:
CAS RN: 103594-43-0
CAS Name: (E)-2-[(E)-1-cyano-2-methoxyethenyl]sulfonyl-3-methoxy-2-propenenitrile
OPENEYE Name: (E)-2-[(E)-1-cyano-2-methoxy-vinyl]sulfonyl-3-methoxy-prop-2-enenitrile
IUPAC Name: (E)-2-[(E)-1-cyano-2-methoxyethenyl]sulfonyl-3-methoxyprop-2-enenitrile
SYSTEMATIC NAME: (E)-2-[(E)-1-cyano-2-methoxy-ethenyl]sulfonyl-3-methoxy-prop-2-enenitrile
MOLECULAR FORMULA: C8H8N2O4S
MOLECULAR WEIGHT: 228.22512
SMILES: CO/C=C(/S(=O)(=O)/C(=C/OC)/C#N)\C#N
Structure:
CAS RN: 112831-03-5
CAS Name: (E)-2-[(E)-1-cyano-2-methoxyethenyl]sulfonyl-3-methoxy-2-propenenitrile
OPENEYE Name: (E)-2-[(E)-1-cyano-2-methoxy-vinyl]sulfonyl-3-methoxy-prop-2-enenitrile
IUPAC Name: (E)-2-[(E)-1-cyano-2-methoxyethenyl]sulfonyl-3-methoxyprop-2-enenitrile
SYSTEMATIC NAME: (E)-2-[(E)-1-cyano-2-methoxy-ethenyl]sulfonyl-3-methoxy-prop-2-enenitrile
MOLECULAR FORMULA: C8H8N2O4S
MOLECULAR WEIGHT: 228.22512
SMILES: CO/C=C(/S(=O)(=O)/C(=C/OC)/C#N)\C#N
Structure:
CAS RN: 80648-28-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H22O7
MOLECULAR WEIGHT: 362.37378
SMILES: CC1C2CC(=O)O[C@H]3[C@@]2(C(=C(C1=O)O)[C@@](C3)(C)[C@@H]4C(=CC(=O)O4)C)CO
Structure:
CAS RN: 42204-09-1
CAS Name: 9-(2-oxolanyl)-3H-purine-6-thione
OPENEYE Name: 9-tetrahydrofuran-2-yl-3H-purine-6-thione
IUPAC Name: 9-(oxolan-2-yl)-3H-purine-6-thione
SYSTEMATIC NAME: 9-(oxolan-2-yl)-3H-purine-6-thione
MOLECULAR FORMULA: C9H10N4OS
MOLECULAR WEIGHT: 222.2669
SMILES: C1CC(OC1)N2C=NC3=C2NC=NC3=S
Structure:
CAS RN: 131645-71-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H20ClN3S
MOLECULAR WEIGHT: 321.8681
SMILES: C[C@@H]1CN2C3=C(C=C(C=C3CN1CC=C(C)C)Cl)NC2=S
Structure:
CAS RN: 66639-43-8
CAS Name: 4-[5-(4-carbamimidoylphenyl)-1H-pyrrol-2-yl]benzenecarboximidamide
OPENEYE Name: 4-[5-(4-carbamimidoylphenyl)-1H-pyrrol-2-yl]benzamidine
IUPAC Name: 4-[5-(4-carbamimidoylphenyl)-1H-pyrrol-2-yl]benzenecarboximidamide
SYSTEMATIC NAME: 4-[5-(4-carbamimidoylphenyl)-1H-pyrrol-2-yl]benzenecarboximidamide
MOLECULAR FORMULA: C18H17N5
MOLECULAR WEIGHT: 303.36108
SMILES: C1=CC(=CC=C1C2=CC=C(N2)C3=CC=C(C=C3)C(=N)N)C(=N)N
Structure:
CAS RN: 7471-19-4
CAS Name: 7-chloro-4-methyl-1H-quinoline-2-thione
OPENEYE Name: 7-chloro-4-methyl-1H-quinoline-2-thione
IUPAC Name: 7-chloro-4-methyl-1H-quinoline-2-thione
SYSTEMATIC NAME: 7-chloranyl-4-methyl-1H-quinoline-2-thione
MOLECULAR FORMULA: C10H8ClNS
MOLECULAR WEIGHT: 209.69522
SMILES: CC1=CC(=S)NC2=C1C=CC(=C2)Cl
Structure:
CAS RN: 68468-39-3
CAS Name: 5-bromo-1,3-dihydrobenzimidazole-2-thione
OPENEYE Name: 5-bromo-1,3-dihydrobenzimidazole-2-thione
IUPAC Name: 5-bromo-1,3-dihydrobenzimidazole-2-thione
SYSTEMATIC NAME: 5-bromanyl-1,3-dihydrobenzimidazole-2-thione
MOLECULAR FORMULA: C7H5BrN2S
MOLECULAR WEIGHT: 229.097
SMILES: C1=CC2=C(C=C1Br)NC(=S)N2
Structure:
CAS RN: 767-17-9
CAS Name: 2,6-diamino-1H-1,3,5-triazine-4-thione
OPENEYE Name: 2,6-diamino-1H-1,3,5-triazine-4-thione
IUPAC Name: 2,6-diamino-1H-1,3,5-triazine-4-thione
SYSTEMATIC NAME: 2,6-bis(azanyl)-1H-1,3,5-triazine-4-thione
MOLECULAR FORMULA: C3H5N5S
MOLECULAR WEIGHT: 143.1703
SMILES: C1(=NC(=S)N=C(N1)N)N
Structure:
CAS RN: 15666-86-1
CAS Name: 2,6-diamino-1H-1,3,5-triazine-4-thione
OPENEYE Name: 2,6-diamino-1H-1,3,5-triazine-4-thione
IUPAC Name: 2,6-diamino-1H-1,3,5-triazine-4-thione
SYSTEMATIC NAME: 2,6-bis(azanyl)-1H-1,3,5-triazine-4-thione
MOLECULAR FORMULA: C3H5N5S
MOLECULAR WEIGHT: 143.1703
SMILES: C1(=NC(=S)N=C(N1)N)N
Structure:
CAS RN: 4595-95-3
CAS Name: 2,6-diamino-1H-1,3,5-triazine-4-thione
OPENEYE Name: 2,6-diamino-1H-1,3,5-triazine-4-thione
IUPAC Name: 2,6-diamino-1H-1,3,5-triazine-4-thione
SYSTEMATIC NAME: 2,6-bis(azanyl)-1H-1,3,5-triazine-4-thione
MOLECULAR FORMULA: C3H5N5S
MOLECULAR WEIGHT: 143.1703
SMILES: C1(=NC(=S)N=C(N1)N)N
Structure:
CAS RN: 63073-29-0
CAS Name: 2,6-diamino-1H-1,3,5-triazine-4-thione
OPENEYE Name: 2,6-diamino-1H-1,3,5-triazine-4-thione
IUPAC Name: 2,6-diamino-1H-1,3,5-triazine-4-thione
SYSTEMATIC NAME: 2,6-bis(azanyl)-1H-1,3,5-triazine-4-thione
MOLECULAR FORMULA: C3H5N5S
MOLECULAR WEIGHT: 143.1703
SMILES: C1(=NC(=S)N=C(N1)N)N
Structure:
CAS RN: 1986-44-3
CAS Name: 5-methyl-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 5-methyl-2-thioxo-thiazolidin-4-one
IUPAC Name: 5-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 5-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C4H5NOS2
MOLECULAR WEIGHT: 147.2186
SMILES: CC1C(=O)NC(=S)S1
Structure:
CAS RN: 2103-88-0
CAS Name: 4-phenyl-3H-thiazole-2-thione
OPENEYE Name: 4-phenyl-3H-thiazole-2-thione
IUPAC Name: 4-phenyl-3H-1,3-thiazole-2-thione
SYSTEMATIC NAME: 4-phenyl-3H-1,3-thiazole-2-thione
MOLECULAR FORMULA: C9H7NS2
MOLECULAR WEIGHT: 193.28858
SMILES: C1=CC=C(C=C1)C2=CSC(=S)N2
Structure:
CAS RN: 17374-08-2
CAS Name: 4-phenyl-3H-thiazole-2-thione
OPENEYE Name: 4-phenyl-3H-thiazole-2-thione
IUPAC Name: 4-phenyl-3H-1,3-thiazole-2-thione
SYSTEMATIC NAME: 4-phenyl-3H-1,3-thiazole-2-thione
MOLECULAR FORMULA: C9H7NS2
MOLECULAR WEIGHT: 193.28858
SMILES: C1=CC=C(C=C1)C2=CSC(=S)N2
Structure:
CAS RN: 92-96-6
CAS Name: 1,3-bis(4-phenylphenyl)thiourea
OPENEYE Name: 1,3-bis(4-phenylphenyl)thiourea
IUPAC Name: 1,3-bis(4-phenylphenyl)thiourea
SYSTEMATIC NAME: 1,3-bis(4-phenylphenyl)thiourea
MOLECULAR FORMULA: C25H20N2S
MOLECULAR WEIGHT: 380.5047
SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)C4=CC=CC=C4
Structure:
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