3-(aminocarbonylamino)-N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-(2-methylphenyl)propanamide

Systemtic Name: 3-(aminocarbonylamino)-N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-(2-methylphenyl)propanamide Openeye Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-(o-tolyl)-3-ureido-propanamide CAS Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-3-(carbamoylamino)-N-methyl-3-(2-methylphenyl)propanamide IUPAC Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-3-(carbamoylamino)-N-methyl-3-(2-methylphenyl)propanamide Traditional Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-(o-tolyl)-3-ureido-propionamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CC(=O)N(C)C(C)C2=NC3=CC=CC=C3S2)NC(=O)N

Isomeric SMILES

CC1=CC=CC=C1C(CC(=O)N(C)C(C)C2=NC3=CC=CC=C3S2)NC(=O)N

InChI

InChI=1S/C21H24N4O2S/c1-13-8-4-5-9-15(13)17(24-21(22)27)12-19(26)25(3)14(2)20-23-16-10-6-7-11-18(16)28-20/h4-11,14,17H,12H2,1-3H3,(H3,22,24,27)