4-[2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]ethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 4-[2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]ethanoylamino]-N,N-diethyl-benzamide Openeye Name: 4-[[2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetyl]amino]-N,N-diethyl-benzamide CAS Name: 4-[[2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 4-[[2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetyl]amino]-N,N-diethylbenzamide Traditional Name: 4-[[2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]acetyl]amino]-N,N-diethyl-benzamide Formula: C28H27N5O2S MolecularWeight: 497.61128

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H27N5O2S/c1-3-33(4-2)27(35)22-15-17-23(18-16-22)29-24(34)19-36-28-30-25(20-11-7-5-8-12-20)26(31-32-28)21-13-9-6-10-14-21/h5-18H,3-4,19H2,1-2H3,(H,29,34)