N-[3-cyano-4-methyl-5-(phenylmethyl)-1H-pyrrol-2-yl]-2-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[3-cyano-4-methyl-5-(phenylmethyl)-1H-pyrrol-2-yl]-2-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanyl]ethanamide Openeye Name: N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)-2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]acetamide CAS Name: N-[3-cyano-4-methyl-5-(phenylmethyl)-1H-pyrrol-2-yl]-2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)thio]acetamide IUPAC Name: N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)-2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]acetamide Traditional Name: N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)-2-[(5-keto-6-methyl-2H-1,2,4-triazin-3-yl)thio]acetamide Formula: C19H18N6O2S MolecularWeight: 394.45022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C#N)NC(=O)CSC2=NC(=O)C(=NN2)C)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C#N)NC(=O)CSC2=NC(=O)C(=NN2)C)CC3=CC=CC=C3

InChI

InChI=1S/C19H18N6O2S/c1-11-14(9-20)17(21-15(11)8-13-6-4-3-5-7-13)22-16(26)10-28-19-23-18(27)12(2)24-25-19/h3-7,21H,8,10H2,1-2H3,(H,22,26)(H,23,25,27)