2-[2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(3-methylphenyl)benzamide

Systemtic Name: 2-[2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(3-methylphenyl)benzamide Openeye Name: 2-[[2-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-N-(m-tolyl)benzamide CAS Name: 2-[[2-[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-N-(3-methylphenyl)benzamide IUPAC Name: 2-[[2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-(3-methylphenyl)benzamide Traditional Name: 2-[[2-[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]acetyl]amino]-N-(m-tolyl)benzamide Formula: C26H30N6O2S MolecularWeight: 490.6204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NN=C(N3C4CC4)N5CCCCC5

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NN=C(N3C4CC4)N5CCCCC5

InChI

InChI=1S/C26H30N6O2S/c1-18-8-7-9-19(16-18)27-24(34)21-10-3-4-11-22(21)28-23(33)17-35-26-30-29-25(32(26)20-12-13-20)31-14-5-2-6-15-31/h3-4,7-11,16,20H,2,5-6,12-15,17H2,1H3,(H,27,34)(H,28,33)