3-(aminocarbonylamino)-N-[2-(3,4-dimethylphenyl)sulfanylethyl]-3-(3-methylphenyl)propanamide

Systemtic Name: 3-(aminocarbonylamino)-N-[2-(3,4-dimethylphenyl)sulfanylethyl]-3-(3-methylphenyl)propanamide Openeye Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-3-(m-tolyl)-3-ureido-propanamide CAS Name: 3-(carbamoylamino)-N-[2-[(3,4-dimethylphenyl)thio]ethyl]-3-(3-methylphenyl)propanamide IUPAC Name: 3-(carbamoylamino)-N-[2-(3,4-dimethylphenyl)sulfanylethyl]-3-(3-methylphenyl)propanamide Traditional Name: N-[2-[(3,4-dimethylphenyl)thio]ethyl]-3-(m-tolyl)-3-ureido-propionamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CC(=O)NCCSC2=CC(=C(C=C2)C)C)NC(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)C(CC(=O)NCCSC2=CC(=C(C=C2)C)C)NC(=O)N

InChI

InChI=1S/C21H27N3O2S/c1-14-5-4-6-17(11-14)19(24-21(22)26)13-20(25)23-9-10-27-18-8-7-15(2)16(3)12-18/h4-8,11-12,19H,9-10,13H2,1-3H3,(H,23,25)(H3,22,24,26)