N-(1-phenylethyl)-2-[2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide

Systemtic Name: N-(1-phenylethyl)-2-[2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: N-(1-phenylethyl)-2-[[2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide CAS Name: 2-[[1-oxo-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]ethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: N-(1-phenylethyl)-2-[[2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: N-(1-phenylethyl)-2-[[2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetyl]amino]benzamide Formula: C25H23N5O2S MolecularWeight: 457.54742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NN=CN3C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NN=CN3C4=CC=CC=C4

InChI

InChI=1S/C25H23N5O2S/c1-18(19-10-4-2-5-11-19)27-24(32)21-14-8-9-15-22(21)28-23(31)16-33-25-29-26-17-30(25)20-12-6-3-7-13-20/h2-15,17-18H,16H2,1H3,(H,27,32)(H,28,31)