3-[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N,N-dimethyl-benzamide

Systemtic Name: 3-[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N,N-dimethyl-benzamide Openeye Name: 3-[[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N,N-dimethyl-benzamide CAS Name: 3-[[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-N,N-dimethylbenzamide IUPAC Name: 3-[[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N,N-dimethylbenzamide Traditional Name: 3-[[2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]acetyl]amino]-N,N-dimethyl-benzamide Formula: C25H23N5O2S MolecularWeight: 457.54742

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(C)C(=O)C1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H23N5O2S/c1-29(2)24(32)19-12-9-13-20(16-19)26-22(31)17-33-25-28-27-23(18-10-5-3-6-11-18)30(25)21-14-7-4-8-15-21/h3-16H,17H2,1-2H3,(H,26,31)