3-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-phenethyl-N-(phenylmethyl)benzamide

Systemtic Name: 3-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-phenethyl-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-phenethyl-benzamide CAS Name: 3-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-N-phenethyl-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-phenethylbenzamide Traditional Name: N-benzyl-3-[[2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-N-phenethyl-benzamide Formula: C27H27N5O2S MolecularWeight: 485.60058

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CN1C=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H27N5O2S/c1-31-20-28-30-27(31)35-19-25(33)29-24-14-8-13-23(17-24)26(34)32(18-22-11-6-3-7-12-22)16-15-21-9-4-2-5-10-21/h2-14,17,20H,15-16,18-19H2,1H3,(H,29,33)