3-(2-chlorophenyl)-N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[(4-isopentyloxyphenyl)carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[4-(3-methylbutoxy)anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[(4-isoamoxyphenyl)thiocarbamoyl]propionamide Formula: C21H25ClN2O2S MolecularWeight: 404.9534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)NC(=S)NC(=O)CCC2=CC=CC=C2Cl

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)NC(=S)NC(=O)CCC2=CC=CC=C2Cl

InChI

InChI=1S/C21H25ClN2O2S/c1-15(2)13-14-26-18-10-8-17(9-11-18)23-21(27)24-20(25)12-7-16-5-3-4-6-19(16)22/h3-6,8-11,15H,7,12-14H2,1-2H3,(H2,23,24,25,27)