N-[4-[1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-3-methyl-benzamide

Systemtic Name: N-[4-[1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-propan-2-yl]sulfanylphenyl]-3-methyl-benzamide Openeye Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]-3-methyl-benzamide CAS Name: N-[4-[[1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl]thio]phenyl]-3-methylbenzamide IUPAC Name: N-[4-[1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl]sulfanylphenyl]-3-methylbenzamide Traditional Name: N-[4-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-1-methyl-ethyl]thio]phenyl]-3-methyl-benzamide Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)SC(C)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)SC(C)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H22N2O4S/c1-15-4-3-5-17(12-15)24(28)25-18-6-9-20(10-7-18)31-16(2)23(27)26-19-8-11-21-22(13-19)30-14-29-21/h3-13,16H,14H2,1-2H3,(H,25,28)(H,26,27)