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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[2-(cyclooctylamino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(cyclooctylamino)-2-oxoethyl]thio]benzamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[2-(cyclooctylamino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(cyclooctylamino)-2-keto-ethyl]thio]benzamide Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H28N2O4S/c27-23(25-17-8-4-2-1-3-5-9-17)15-31-22-11-7-6-10-19(22)24(28)26-18-12-13-20-21(14-18)30-16-29-20/h6-7,10-14,17H,1-5,8-9,15-16H2,(H,25,27)(H,26,28)