N-(cyclohexylcarbamoyl)-2-[[4-cyclopropyl-5-(4-methylpiperidin-1-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(cyclohexylcarbamoyl)-2-[[4-cyclopropyl-5-(4-methylpiperidin-1-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(cyclohexylcarbamoyl)-2-[[4-cyclopropyl-5-(4-methyl-1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-[(cyclohexylamino)-oxomethyl]-2-[[4-cyclopropyl-5-(4-methyl-1-piperidinyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(cyclohexylcarbamoyl)-2-[[4-cyclopropyl-5-(4-methylpiperidin-1-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(cyclohexylcarbamoyl)-2-[[4-cyclopropyl-5-(4-methylpiperidino)-1,2,4-triazol-3-yl]thio]propionamide Formula: C21H34N6O2S MolecularWeight: 434.59866

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NN=C(N2C3CC3)SC(C)C(=O)NC(=O)NC4CCCCC4

Isomeric SMILES

CC1CCN(CC1)C2=NN=C(N2C3CC3)SC(C)C(=O)NC(=O)NC4CCCCC4

InChI

InChI=1S/C21H34N6O2S/c1-14-10-12-26(13-11-14)20-24-25-21(27(20)17-8-9-17)30-15(2)18(28)23-19(29)22-16-6-4-3-5-7-16/h14-17H,3-13H2,1-2H3,(H2,22,23,28,29)