methyl 2-[[1-(2-methoxyethyl)cyclopentyl]carbothioylamino]-3-(4-methylphenyl)propanoate

Systemtic Name: methyl 2-[[1-(2-methoxyethyl)cyclopentyl]carbothioylamino]-3-(4-methylphenyl)propanoate Openeye Name: methyl 2-[[1-(2-methoxyethyl)cyclopentanecarbothioyl]amino]-3-(p-tolyl)propanoate CAS Name: 2-[[[1-(2-methoxyethyl)cyclopentyl]-sulfanylidenemethyl]amino]-3-(4-methylphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[[1-(2-methoxyethyl)cyclopentanecarbothioyl]amino]-3-(4-methylphenyl)propanoate Traditional Name: 2-[[1-(2-methoxyethyl)cyclopentanecarbothioyl]amino]-3-(p-tolyl)propionic acid methyl ester Formula: C20H29NO3S MolecularWeight: 363.51416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C(=O)OC)NC(=S)C2(CCCC2)CCOC

Isomeric SMILES

CC1=CC=C(C=C1)CC(C(=O)OC)NC(=S)C2(CCCC2)CCOC

InChI

InChI=1S/C20H29NO3S/c1-15-6-8-16(9-7-15)14-17(18(22)24-3)21-19(25)20(12-13-23-2)10-4-5-11-20/h6-9,17H,4-5,10-14H2,1-3H3,(H,21,25)