methyl 2-[(3-chloranyl-4-methoxy-phenyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[(3-chloranyl-4-methoxy-phenyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[(3-chloro-4-methoxy-phenyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[(3-chloro-4-methoxyanilino)-sulfanylidenemethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(3-chloro-4-methoxyphenyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[(3-chloro-4-methoxy-phenyl)thiocarbamoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C17H17ClN2O3S2 MolecularWeight: 396.91148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC2=C(C3=C(S2)CCC3)C(=O)OC)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC2=C(C3=C(S2)CCC3)C(=O)OC)Cl

InChI

InChI=1S/C17H17ClN2O3S2/c1-22-12-7-6-9(8-11(12)18)19-17(24)20-15-14(16(21)23-2)10-4-3-5-13(10)25-15/h6-8H,3-5H2,1-2H3,(H2,19,20,24)