5-[[3-(cyclopropylcarbamoyl)-4-(4-methylphenyl)thiophen-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[[3-(cyclopropylcarbamoyl)-4-(4-methylphenyl)thiophen-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[[3-(cyclopropylcarbamoyl)-4-(p-tolyl)-2-thienyl]amino]-5-oxo-pentanoate CAS Name: 5-[[3-[(cyclopropylamino)-oxomethyl]-4-(4-methylphenyl)-2-thiophenyl]amino]-5-oxopentanoate IUPAC Name: 5-[[3-(cyclopropylcarbamoyl)-4-(4-methylphenyl)thiophen-2-yl]amino]-5-oxopentanoate Traditional Name: 5-[[3-(cyclopropylcarbamoyl)-4-(p-tolyl)-2-thienyl]amino]-5-keto-valerate Formula: C20H21N2O4S- MolecularWeight: 385.45674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)NC3CC3)NC(=O)CCCC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)NC3CC3)NC(=O)CCCC(=O)[O-]

InChI

InChI=1S/C20H22N2O4S/c1-12-5-7-13(8-6-12)15-11-27-20(18(15)19(26)21-14-9-10-14)22-16(23)3-2-4-17(24)25/h5-8,11,14H,2-4,9-10H2,1H3,(H,21,26)(H,22,23)(H,24,25)/p-1