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

Systemtic Name: N-phenethyl-2-[2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzamide Openeye Name: N-phenethyl-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-phenethylbenzamide IUPAC Name: N-phenethyl-2-[[2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzamide Traditional Name: N-phenethyl-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:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N5O2S/c31-23(17-33-25-29-27-18-30(25)20-11-5-2-6-12-20)28-22-14-8-7-13-21(22)24(32)26-16-15-19-9-3-1-4-10-19/h1-14,18H,15-17H2,(H,26,32)(H,28,31)