2-[5-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]sulfanyl-3-pyridin-4-yl-1,2,4-triazol-1-yl]-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[5-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]sulfanyl-3-pyridin-4-yl-1,2,4-triazol-1-yl]-N-(3-methylphenyl)ethanamide Openeye Name: 2-[5-[2-(cyclopentylamino)-2-oxo-ethyl]sulfanyl-3-(4-pyridyl)-1,2,4-triazol-1-yl]-N-(m-tolyl)acetamide CAS Name: 2-[5-[[2-(cyclopentylamino)-2-oxoethyl]thio]-3-pyridin-4-yl-1,2,4-triazol-1-yl]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[5-[2-(cyclopentylamino)-2-oxoethyl]sulfanyl-3-pyridin-4-yl-1,2,4-triazol-1-yl]-N-(3-methylphenyl)acetamide Traditional Name: 2-[5-[[2-(cyclopentylamino)-2-keto-ethyl]thio]-3-(4-pyridyl)-1,2,4-triazol-1-yl]-N-(m-tolyl)acetamide Formula: C23H26N6O2S MolecularWeight: 450.55654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CN2C(=NC(=N2)C3=CC=NC=C3)SCC(=O)NC4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CN2C(=NC(=N2)C3=CC=NC=C3)SCC(=O)NC4CCCC4

InChI

InChI=1S/C23H26N6O2S/c1-16-5-4-8-19(13-16)26-20(30)14-29-23(27-22(28-29)17-9-11-24-12-10-17)32-15-21(31)25-18-6-2-3-7-18/h4-5,8-13,18H,2-3,6-7,14-15H2,1H3,(H,25,31)(H,26,30)