ethyl 5-[2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[2-(1-amino-4-phenyl-imidazol-2-yl)sulfanylacetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-[(1-amino-4-phenyl-2-imidazolyl)thio]-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(1-amino-4-phenylimidazol-2-yl)sulfanylacetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[2-[(1-amino-4-phenyl-imidazol-2-yl)thio]acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CSC2=NC(=CN2N)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CSC2=NC(=CN2N)C3=CC=CC=C3)C

InChI

InChI=1S/C19H20N4O3S2/c1-3-26-18(25)17-12(2)9-16(28-17)22-15(24)11-27-19-21-14(10-23(19)20)13-7-5-4-6-8-13/h4-10H,3,11,20H2,1-2H3,(H,22,24)