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

Systemtic Name: 2-[[4-cyclopropyl-5-(4-methylpiperidin-1-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-2-[[4-cyclopropyl-5-(4-methyl-1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-propanamide CAS Name: 2-[[4-cyclopropyl-5-(4-methyl-1-piperidinyl)-1,2,4-triazol-3-yl]thio]-N-methyl-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-2-[[4-cyclopropyl-5-(4-methylpiperidin-1-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-methylpropanamide Traditional Name: N-benzyl-2-[[4-cyclopropyl-5-(4-methylpiperidino)-1,2,4-triazol-3-yl]thio]-N-methyl-propionamide Formula: C22H31N5OS MolecularWeight: 413.57944

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NN=C(N2C3CC3)SC(C)C(=O)N(C)CC4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)C2=NN=C(N2C3CC3)SC(C)C(=O)N(C)CC4=CC=CC=C4

InChI

InChI=1S/C22H31N5OS/c1-16-11-13-26(14-12-16)21-23-24-22(27(21)19-9-10-19)29-17(2)20(28)25(3)15-18-7-5-4-6-8-18/h4-8,16-17,19H,9-15H2,1-3H3