2-[(phenylmethyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid

Systemtic Name: 2-[(phenylmethyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid Openeye Name: 2-(benzylcarbamothioylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid CAS Name: 2-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid IUPAC Name: 2-(benzylcarbamothioylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid Traditional Name: 2-(benzylthiocarbamoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid Formula: C16H16N2O2S2 MolecularWeight: 332.44044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2C(=O)O)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

C1CC2=C(C1)SC(=C2C(=O)O)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C16H16N2O2S2/c19-15(20)13-11-7-4-8-12(11)22-14(13)18-16(21)17-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,19,20)(H2,17,18,21)