4-[[3-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-3-oxidanylidene-propyl]sulfanylmethyl]benzoate

Systemtic Name: 4-[[3-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-3-oxidanylidene-propyl]sulfanylmethyl]benzoate Openeye Name: 4-[[3-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-3-oxo-propyl]sulfanylmethyl]benzoate CAS Name: 4-[[[3-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-3-oxopropyl]thio]methyl]benzoate IUPAC Name: 4-[[3-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-3-oxopropyl]sulfanylmethyl]benzoate Traditional Name: 4-[[[3-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-3-keto-propyl]thio]methyl]benzoate Formula: C19H17N2O3S2- MolecularWeight: 385.47988

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2C#N)NC(=O)CCSCC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1CC2=C(C1)SC(=C2C#N)NC(=O)CCSCC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C19H18N2O3S2/c20-10-15-14-2-1-3-16(14)26-18(15)21-17(22)8-9-25-11-12-4-6-13(7-5-12)19(23)24/h4-7H,1-3,8-9,11H2,(H,21,22)(H,23,24)/p-1