2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-(2-piperidin-1-ylethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-(2-piperidin-1-ylethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-[2-(1-piperidyl)ethyl]thiazole-4-carboxamide CAS Name: 2-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-N-[2-(1-piperidinyl)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-(2-piperidin-1-ylethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-N-(2-piperidinoethyl)thiazole-4-carboxamide Formula: C21H26N6OS2 MolecularWeight: 442.60074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SCC3=NC(=CS3)C(=O)NCCN4CCCCC4

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SCC3=NC(=CS3)C(=O)NCCN4CCCCC4

InChI

InChI=1S/C21H26N6OS2/c1-16-24-25-21(27(16)17-8-4-2-5-9-17)30-15-19-23-18(14-29-19)20(28)22-10-13-26-11-6-3-7-12-26/h2,4-5,8-9,14H,3,6-7,10-13,15H2,1H3,(H,22,28)