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

Systemtic Name: methyl 3-(4-methylphenyl)-2-[(1-propylcyclopentyl)carbothioylamino]propanoate Openeye Name: methyl 2-[(1-propylcyclopentanecarbothioyl)amino]-3-(p-tolyl)propanoate CAS Name: 3-(4-methylphenyl)-2-[[(1-propylcyclopentyl)-sulfanylidenemethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-methylphenyl)-2-[(1-propylcyclopentanecarbothioyl)amino]propanoate Traditional Name: 2-[(1-propylcyclopentanecarbothioyl)amino]-3-(p-tolyl)propionic acid methyl ester Formula: C20H29NO2S MolecularWeight: 347.51476

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCC1)C(=S)NC(CC2=CC=C(C=C2)C)C(=O)OC

Isomeric SMILES

CCCC1(CCCC1)C(=S)NC(CC2=CC=C(C=C2)C)C(=O)OC

InChI

InChI=1S/C20H29NO2S/c1-4-11-20(12-5-6-13-20)19(24)21-17(18(22)23-3)14-16-9-7-15(2)8-10-16/h7-10,17H,4-6,11-14H2,1-3H3,(H,21,24)