N-methyl-N-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-methyl-N-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]-4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-methyl-N-[2-[2-(methylthio)anilino]-2-oxoethyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxoethyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: 4-(2-keto-1,3-benzoxazol-3-yl)-N-[2-keto-2-[2-(methylthio)anilino]ethyl]-N-methyl-butyramide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1SC)C(=O)CCCN2C3=CC=CC=C3OC2=O

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1SC)C(=O)CCCN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C21H23N3O4S/c1-23(14-19(25)22-15-8-3-6-11-18(15)29-2)20(26)12-7-13-24-16-9-4-5-10-17(16)28-21(24)27/h3-6,8-11H,7,12-14H2,1-2H3,(H,22,25)