N-(4-acetamido-2,5-diethoxy-phenyl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-acetamido-2,5-diethoxy-phenyl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-acetamido-2,5-diethoxy-phenyl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide CAS Name: N-(4-acetamido-2,5-diethoxyphenyl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]acetamide IUPAC Name: N-(4-acetamido-2,5-diethoxyphenyl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide Traditional Name: N-(4-acetamido-2,5-diethoxy-phenyl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]acetamide Formula: C29H29N5O4S MolecularWeight: 543.63666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C)OCC)NC(=O)CSC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C)OCC)NC(=O)CSC2=NC(=C(N=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H29N5O4S/c1-4-37-24-17-23(25(38-5-2)16-22(24)30-19(3)35)31-26(36)18-39-29-32-27(20-12-8-6-9-13-20)28(33-34-29)21-14-10-7-11-15-21/h6-17H,4-5,18H2,1-3H3,(H,30,35)(H,31,36)