methyl 2-[[4-aminocarbonyl-3-azanyl-5-(4-fluorophenyl)imino-2H-thiophen-2-yl]carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[[4-aminocarbonyl-3-azanyl-5-(4-fluorophenyl)imino-2H-thiophen-2-yl]carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[[3-amino-4-carbamoyl-5-(4-fluorophenyl)imino-2H-thiophene-2-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[[3-amino-4-carbamoyl-5-(4-fluorophenyl)imino-2H-thiophen-2-yl]-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[3-amino-4-carbamoyl-5-(4-fluorophenyl)imino-2H-thiophene-2-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[3-amino-4-carbamoyl-5-(4-fluorophenyl)imino-2H-thiophene-2-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C21H19FN4O4S2 MolecularWeight: 474.528363

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCC2)NC(=O)C3C(=C(C(=NC4=CC=C(C=C4)F)S3)C(=O)N)N

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCC2)NC(=O)C3C(=C(C(=NC4=CC=C(C=C4)F)S3)C(=O)N)N

InChI

InChI=1S/C21H19FN4O4S2/c1-30-21(29)13-11-3-2-4-12(11)31-19(13)26-18(28)16-15(23)14(17(24)27)20(32-16)25-10-7-5-9(22)6-8-10/h5-8,16H,2-4,23H2,1H3,(H2,24,27)(H,26,28)