N-(3-cyanophenyl)-2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-(3-cyanophenyl)-2-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-(3-cyanophenyl)-2-[2-(cyclooctylamino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(3-cyanophenyl)-2-[[2-(cyclooctylamino)-2-oxoethyl]thio]benzamide IUPAC Name: N-(3-cyanophenyl)-2-[2-(cyclooctylamino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-(3-cyanophenyl)-2-[[2-(cyclooctylamino)-2-keto-ethyl]thio]benzamide Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSC2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSC2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C24H27N3O2S/c25-16-18-9-8-12-20(15-18)27-24(29)21-13-6-7-14-22(21)30-17-23(28)26-19-10-4-2-1-3-5-11-19/h6-9,12-15,19H,1-5,10-11,17H2,(H,26,28)(H,27,29)