N,N-dimethyl-4-[2-[4-[(3-methylphenyl)amino]-4-oxidanylidene-butyl]sulfanylethanoylamino]benzamide

Systemtic Name: N,N-dimethyl-4-[2-[4-[(3-methylphenyl)amino]-4-oxidanylidene-butyl]sulfanylethanoylamino]benzamide Openeye Name: N,N-dimethyl-4-[[2-[4-(3-methylanilino)-4-oxo-butyl]sulfanylacetyl]amino]benzamide CAS Name: N,N-dimethyl-4-[[2-[[4-(3-methylanilino)-4-oxobutyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N,N-dimethyl-4-[[2-[4-(3-methylanilino)-4-oxobutyl]sulfanylacetyl]amino]benzamide Traditional Name: 4-[[2-[[4-keto-4-(m-toluidino)butyl]thio]acetyl]amino]-N,N-dimethyl-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CCCSCC(=O)NC2=CC=C(C=C2)C(=O)N(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CCCSCC(=O)NC2=CC=C(C=C2)C(=O)N(C)C

InChI

InChI=1S/C22H27N3O3S/c1-16-6-4-7-19(14-16)24-20(26)8-5-13-29-15-21(27)23-18-11-9-17(10-12-18)22(28)25(2)3/h4,6-7,9-12,14H,5,8,13,15H2,1-3H3,(H,23,27)(H,24,26)