3-(aminocarbonylamino)-3-(3-methylphenyl)-N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]propanamide

Systemtic Name: 3-(aminocarbonylamino)-3-(3-methylphenyl)-N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]propanamide Openeye Name: N-[4-(4-methylsulfanylphenyl)thiazol-2-yl]-3-(m-tolyl)-3-ureido-propanamide CAS Name: 3-(carbamoylamino)-3-(3-methylphenyl)-N-[4-[4-(methylthio)phenyl]-2-thiazolyl]propanamide IUPAC Name: 3-(carbamoylamino)-3-(3-methylphenyl)-N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]propanamide Traditional Name: N-[4-[4-(methylthio)phenyl]thiazol-2-yl]-3-(m-tolyl)-3-ureido-propionamide Formula: C21H22N4O2S2 MolecularWeight: 426.55498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)SC)NC(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)C(CC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)SC)NC(=O)N

InChI

InChI=1S/C21H22N4O2S2/c1-13-4-3-5-15(10-13)17(23-20(22)27)11-19(26)25-21-24-18(12-29-21)14-6-8-16(28-2)9-7-14/h3-10,12,17H,11H2,1-2H3,(H3,22,23,27)(H,24,25,26)