2-methyl-N-[4-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]phenyl]propanamide

Systemtic Name: 2-methyl-N-[4-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]phenyl]propanamide Openeye Name: 2-methyl-N-[4-[[2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanylacetyl]amino]phenyl]propanamide CAS Name: 2-methyl-N-[4-[[2-[[2-(3-methylanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]phenyl]propanamide IUPAC Name: 2-methyl-N-[4-[[2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetyl]amino]phenyl]propanamide Traditional Name: N-[4-[[2-[[2-keto-2-(m-toluidino)ethyl]thio]acetyl]amino]phenyl]-2-methyl-propionamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC2=CC=C(C=C2)NC(=O)C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC2=CC=C(C=C2)NC(=O)C(C)C

InChI

InChI=1S/C21H25N3O3S/c1-14(2)21(27)24-17-9-7-16(8-10-17)22-19(25)12-28-13-20(26)23-18-6-4-5-15(3)11-18/h4-11,14H,12-13H2,1-3H3,(H,22,25)(H,23,26)(H,24,27)