(3S)-5-[(3-aminocarbonyl-4,5-dihydrobenzo[g][1]benzothiol-2-yl)amino]-3-methyl-5-oxidanylidene-pentanoate

Systemtic Name: (3S)-5-[(3-aminocarbonyl-4,5-dihydrobenzo[g][1]benzothiol-2-yl)amino]-3-methyl-5-oxidanylidene-pentanoate Openeye Name: (3S)-5-[(3-carbamoyl-4,5-dihydrobenzo[g]benzothiophen-2-yl)amino]-3-methyl-5-oxo-pentanoate CAS Name: (3S)-5-[(3-carbamoyl-4,5-dihydrobenzo[g][1]benzothiol-2-yl)amino]-3-methyl-5-oxopentanoate IUPAC Name: (3S)-5-[(3-carbamoyl-4,5-dihydrobenzo[g][1]benzothiol-2-yl)amino]-3-methyl-5-oxopentanoate Traditional Name: (3S)-5-[(3-carbamoyl-4,5-dihydrobenzo[g]benzothiophen-2-yl)amino]-5-keto-3-methyl-valerate Formula: C19H19N2O4S- MolecularWeight: 371.43016

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=C(C2=C(S1)C3=CC=CC=C3CC2)C(=O)N)CC(=O)[O-]

Isomeric SMILES

C[C@@H](CC(=O)NC1=C(C2=C(S1)C3=CC=CC=C3CC2)C(=O)N)CC(=O)[O-]

InChI

InChI=1S/C19H20N2O4S/c1-10(9-15(23)24)8-14(22)21-19-16(18(20)25)13-7-6-11-4-2-3-5-12(11)17(13)26-19/h2-5,10H,6-9H2,1H3,(H2,20,25)(H,21,22)(H,23,24)/p-1/t10-/m0/s1