N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-3-(3,4-dimethylphenyl)sulfanyl-propanamide

Systemtic Name: N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-3-(3,4-dimethylphenyl)sulfanyl-propanamide Openeye Name: N-[2-(cyclopropylamino)-2-oxo-ethyl]-3-(3,4-dimethylphenyl)sulfanyl-propanamide CAS Name: N-[2-(cyclopropylamino)-2-oxoethyl]-3-[(3,4-dimethylphenyl)thio]propanamide IUPAC Name: N-[2-(cyclopropylamino)-2-oxoethyl]-3-(3,4-dimethylphenyl)sulfanylpropanamide Traditional Name: N-[2-(cyclopropylamino)-2-keto-ethyl]-3-[(3,4-dimethylphenyl)thio]propionamide Formula: C16H22N2O2S MolecularWeight: 306.42308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NCC(=O)NC2CC2)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NCC(=O)NC2CC2)C

InChI

InChI=1S/C16H22N2O2S/c1-11-3-6-14(9-12(11)2)21-8-7-15(19)17-10-16(20)18-13-4-5-13/h3,6,9,13H,4-5,7-8,10H2,1-2H3,(H,17,19)(H,18,20)