2-[cyclopentyl-(2,4-diethanoylphenyl)carbothioyl-amino]ethanoic acid

Systemtic Name: 2-[cyclopentyl-(2,4-diethanoylphenyl)carbothioyl-amino]ethanoic acid Openeye Name: 2-[cyclopentyl-(2,4-diacetylbenzenecarbothioyl)amino]acetic acid CAS Name: 2-[cyclopentyl-[(2,4-diacetylphenyl)-sulfanylidenemethyl]amino]acetic acid IUPAC Name: 2-[cyclopentyl-(2,4-diacetylbenzenecarbothioyl)amino]acetic acid Traditional Name: 2-[cyclopentyl-(2,4-diacetylthiobenzoyl)amino]acetic acid Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)C(=S)N(CC(=O)O)C2CCCC2)C(=O)C

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)C(=S)N(CC(=O)O)C2CCCC2)C(=O)C

InChI

InChI=1S/C18H21NO4S/c1-11(20)13-7-8-15(16(9-13)12(2)21)18(24)19(10-17(22)23)14-5-3-4-6-14/h7-9,14H,3-6,10H2,1-2H3,(H,22,23)