1-[2-(3-azanyl-1H-1,2,4-triazol-5-yl)ethanoyl-propyl-amino]-N-(2-methylphenyl)cyclohexane-1-carboxamide

Systemtic Name: 1-[2-(3-azanyl-1H-1,2,4-triazol-5-yl)ethanoyl-propyl-amino]-N-(2-methylphenyl)cyclohexane-1-carboxamide Openeye Name: 1-[[2-(3-amino-1H-1,2,4-triazol-5-yl)acetyl]-propyl-amino]-N-(o-tolyl)cyclohexanecarboxamide CAS Name: 1-[[2-(3-amino-1H-1,2,4-triazol-5-yl)-1-oxoethyl]-propylamino]-N-(2-methylphenyl)-1-cyclohexanecarboxamide IUPAC Name: 1-[[2-(3-amino-1H-1,2,4-triazol-5-yl)acetyl]-propylamino]-N-(2-methylphenyl)cyclohexane-1-carboxamide Traditional Name: 1-[[2-(3-amino-1H-1,2,4-triazol-5-yl)acetyl]-propyl-amino]-N-(o-tolyl)cyclohexanecarboxamide Formula: C21H30N6O2 MolecularWeight: 398.5019

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(=O)CC1=NC(=NN1)N)C2(CCCCC2)C(=O)NC3=CC=CC=C3C

Isomeric SMILES

CCCN(C(=O)CC1=NC(=NN1)N)C2(CCCCC2)C(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C21H30N6O2/c1-3-13-27(18(28)14-17-24-20(22)26-25-17)21(11-7-4-8-12-21)19(29)23-16-10-6-5-9-15(16)2/h5-6,9-10H,3-4,7-8,11-14H2,1-2H3,(H,23,29)(H3,22,24,25,26)