methyl 4-[[cyclopropylmethyl(propyl)carbamothioyl]amino]benzoate

Systemtic Name: methyl 4-[[cyclopropylmethyl(propyl)carbamothioyl]amino]benzoate Openeye Name: methyl 4-[[cyclopropylmethyl(propyl)carbamothioyl]amino]benzoate CAS Name: 4-[[[cyclopropylmethyl(propyl)amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[cyclopropylmethyl(propyl)carbamothioyl]amino]benzoate Traditional Name: 4-[[cyclopropylmethyl(propyl)thiocarbamoyl]amino]benzoic acid methyl ester Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1CC1)C(=S)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCN(CC1CC1)C(=S)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C16H22N2O2S/c1-3-10-18(11-12-4-5-12)16(21)17-14-8-6-13(7-9-14)15(19)20-2/h6-9,12H,3-5,10-11H2,1-2H3,(H,17,21)