5-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-3,3-dimethyl-5-oxo-pentanoic acid CAS Name: 5-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-5-keto-3,3-dimethyl-valeric acid Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)N)CC(=O)O

Isomeric SMILES

CC(C)(CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)N)CC(=O)O

InChI

InChI=1S/C16H22N2O4S/c1-16(2,8-12(20)21)7-11(19)18-15-13(14(17)22)9-5-3-4-6-10(9)23-15/h3-8H2,1-2H3,(H2,17,22)(H,18,19)(H,20,21)