2-[methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]-N-(2-phenylsulfanylphenyl)propanamide

Systemtic Name: 2-[methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]-N-(2-phenylsulfanylphenyl)propanamide Openeye Name: 2-[[2-(isopropylamino)-2-oxo-ethyl]-methyl-amino]-N-(2-phenylsulfanylphenyl)propanamide CAS Name: 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-[2-(phenylthio)phenyl]propanamide IUPAC Name: 2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-phenylsulfanylphenyl)propanamide Traditional Name: 2-[[2-(isopropylamino)-2-keto-ethyl]-methyl-amino]-N-[2-(phenylthio)phenyl]propionamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN(C)C(C)C(=O)NC1=CC=CC=C1SC2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=O)CN(C)C(C)C(=O)NC1=CC=CC=C1SC2=CC=CC=C2

InChI

InChI=1S/C21H27N3O2S/c1-15(2)22-20(25)14-24(4)16(3)21(26)23-18-12-8-9-13-19(18)27-17-10-6-5-7-11-17/h5-13,15-16H,14H2,1-4H3,(H,22,25)(H,23,26)