2-[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(2-quinolin-8-ylethyl)benzamide

Systemtic Name: 2-[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(2-quinolin-8-ylethyl)benzamide Openeye Name: 2-[2-[cyclohexyl(methyl)amino]-2-oxo-ethyl]sulfanyl-N-[2-(8-quinolyl)ethyl]benzamide CAS Name: 2-[[2-[cyclohexyl(methyl)amino]-2-oxoethyl]thio]-N-[2-(8-quinolinyl)ethyl]benzamide IUPAC Name: 2-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]sulfanyl-N-(2-quinolin-8-ylethyl)benzamide Traditional Name: 2-[[2-[cyclohexyl(methyl)amino]-2-keto-ethyl]thio]-N-[2-(8-quinolyl)ethyl]benzamide Formula: C27H31N3O2S MolecularWeight: 461.61894

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CSC2=CC=CC=C2C(=O)NCCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CN(C1CCCCC1)C(=O)CSC2=CC=CC=C2C(=O)NCCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C27H31N3O2S/c1-30(22-12-3-2-4-13-22)25(31)19-33-24-15-6-5-14-23(24)27(32)29-18-16-21-10-7-9-20-11-8-17-28-26(20)21/h5-11,14-15,17,22H,2-4,12-13,16,18-19H2,1H3,(H,29,32)