4-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]-N-(phenylmethyl)piperidine-1-carboxamide

Systemtic Name: 4-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]-N-(phenylmethyl)piperidine-1-carboxamide Openeye Name: 4-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]-N-benzyl-piperidine-1-carboxamide CAS Name: 4-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-1,2,4-triazol-3-yl]-N-(phenylmethyl)-1-piperidinecarboxamide IUPAC Name: 4-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,2,4-triazol-3-yl]-N-benzylpiperidine-1-carboxamide Traditional Name: 4-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-1,2,4-triazol-3-yl]-N-benzyl-piperidine-1-carboxamide Formula: C18H24N6O2S MolecularWeight: 388.48716

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N)C2CCN(CC2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N)C2CCN(CC2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C18H24N6O2S/c1-23-16(21-22-18(23)27-12-15(19)25)14-7-9-24(10-8-14)17(26)20-11-13-5-3-2-4-6-13/h2-6,14H,7-12H2,1H3,(H2,19,25)(H,20,26)