N-[(1-methylindol-2-yl)methyl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(1-methylindol-2-yl)methyl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(1-methylindol-2-yl)methyl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(1-methyl-2-indolyl)methyl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(1-methylindol-2-yl)methyl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[(1-methylindol-2-yl)methyl]-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1CNC(=O)CSC3=NN=C(N3C)C4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2C=C1CNC(=O)CSC3=NN=C(N3C)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5OS/c1-25-17(12-16-10-6-7-11-18(16)25)13-22-19(27)14-28-21-24-23-20(26(21)2)15-8-4-3-5-9-15/h3-12H,13-14H2,1-2H3,(H,22,27)