5-[[3-aminocarbonyl-5-(phenylmethyl)thiophen-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[[3-aminocarbonyl-5-(phenylmethyl)thiophen-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[(5-benzyl-3-carbamoyl-2-thienyl)amino]-5-oxo-pentanoate CAS Name: 5-[[3-carbamoyl-5-(phenylmethyl)-2-thiophenyl]amino]-5-oxopentanoate IUPAC Name: 5-[(5-benzyl-3-carbamoylthiophen-2-yl)amino]-5-oxopentanoate Traditional Name: 5-[(5-benzyl-3-carbamoyl-2-thienyl)amino]-5-keto-valerate Formula: C17H17N2O4S- MolecularWeight: 345.39288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=C(S2)NC(=O)CCCC(=O)[O-])C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=C(S2)NC(=O)CCCC(=O)[O-])C(=O)N

InChI

InChI=1S/C17H18N2O4S/c18-16(23)13-10-12(9-11-5-2-1-3-6-11)24-17(13)19-14(20)7-4-8-15(21)22/h1-3,5-6,10H,4,7-9H2,(H2,18,23)(H,19,20)(H,21,22)/p-1