5-[[4-ethyl-5-methyl-3-[(phenylmethyl)carbamoyl]thiophen-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[[4-ethyl-5-methyl-3-[(phenylmethyl)carbamoyl]thiophen-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[[3-(benzylcarbamoyl)-4-ethyl-5-methyl-2-thienyl]amino]-5-oxo-pentanoate CAS Name: 5-[[4-ethyl-5-methyl-3-[oxo-[(phenylmethyl)amino]methyl]-2-thiophenyl]amino]-5-oxopentanoate IUPAC Name: 5-[[3-(benzylcarbamoyl)-4-ethyl-5-methylthiophen-2-yl]amino]-5-oxopentanoate Traditional Name: 5-[[3-(benzylcarbamoyl)-4-ethyl-5-methyl-2-thienyl]amino]-5-keto-valerate Formula: C20H23N2O4S- MolecularWeight: 387.47262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)NCC2=CC=CC=C2)NC(=O)CCCC(=O)[O-])C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)NCC2=CC=CC=C2)NC(=O)CCCC(=O)[O-])C

InChI

InChI=1S/C20H24N2O4S/c1-3-15-13(2)27-20(22-16(23)10-7-11-17(24)25)18(15)19(26)21-12-14-8-5-4-6-9-14/h4-6,8-9H,3,7,10-12H2,1-2H3,(H,21,26)(H,22,23)(H,24,25)/p-1