1-methyl-N-[2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]pyrrole-2-carboxamide

Systemtic Name: 1-methyl-N-[2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]pyrrole-2-carboxamide Openeye Name: N-[2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-1-methyl-pyrrole-2-carboxamide CAS Name: 1-methyl-N-[2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-2-pyrrolecarboxamide IUPAC Name: N-[2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)thio]acetyl]-1-methyl-pyrrole-2-carboxamide Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC2=CC=CC=C2)SCC(=O)NC(=O)C3=CC=CN3C

Isomeric SMILES

CC1=NN=C(N1CC2=CC=CC=C2)SCC(=O)NC(=O)C3=CC=CN3C

InChI

InChI=1S/C18H19N5O2S/c1-13-20-21-18(23(13)11-14-7-4-3-5-8-14)26-12-16(24)19-17(25)15-9-6-10-22(15)2/h3-10H,11-12H2,1-2H3,(H,19,24,25)