N-(1,3-benzodioxol-5-yl)-2-[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[2-(cyclohexylmethylamino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(cyclohexylmethylamino)-2-oxoethyl]thio]benzamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[2-(cyclohexylmethylamino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(cyclohexylmethylamino)-2-keto-ethyl]thio]benzamide Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)CSC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(CC1)CNC(=O)CSC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H26N2O4S/c26-22(24-13-16-6-2-1-3-7-16)14-30-21-9-5-4-8-18(21)23(27)25-17-10-11-19-20(12-17)29-15-28-19/h4-5,8-12,16H,1-3,6-7,13-15H2,(H,24,26)(H,25,27)