N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(3-cyanoanilino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(3-cyanoanilino)-2-oxoethyl]thio]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(3-cyanoanilino)-2-oxoethyl]sulfanylbenzamide Traditional Name: 2-[[2-(3-cyanoanilino)-2-keto-ethyl]thio]-N-piperonyl-benzamide Formula: C24H19N3O4S MolecularWeight: 445.49036

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3SCC(=O)NC4=CC=CC(=C4)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3SCC(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C24H19N3O4S/c25-12-16-4-3-5-18(10-16)27-23(28)14-32-22-7-2-1-6-19(22)24(29)26-13-17-8-9-20-21(11-17)31-15-30-20/h1-11H,13-15H2,(H,26,29)(H,27,28)