N-(2-methyl-1H-indol-5-yl)-3-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: N-(2-methyl-1H-indol-5-yl)-3-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: N-(2-methyl-1H-indol-5-yl)-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide CAS Name: N-(2-methyl-1H-indol-5-yl)-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-(2-methyl-1H-indol-5-yl)-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: N-(2-methyl-1H-indol-5-yl)-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetyl]amino]benzamide Formula: C21H20N6O2S MolecularWeight: 420.4875

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1)C=CC(=C2)NC(=O)C3=CC(=CC=C3)NC(=O)CSC4=NN=CN4C

Isomeric SMILES

CC1=CC2=C(N1)C=CC(=C2)NC(=O)C3=CC(=CC=C3)NC(=O)CSC4=NN=CN4C

InChI

InChI=1S/C21H20N6O2S/c1-13-8-15-10-17(6-7-18(15)23-13)25-20(29)14-4-3-5-16(9-14)24-19(28)11-30-21-26-22-12-27(21)2/h3-10,12,23H,11H2,1-2H3,(H,24,28)(H,25,29)