2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(2-methoxydibenzofuran-3-yl)propanamide

Systemtic Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(2-methoxydibenzofuran-3-yl)propanamide Openeye Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(2-methoxydibenzofuran-3-yl)propanamide CAS Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(2-methoxy-3-dibenzofuranyl)propanamide IUPAC Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(2-methoxydibenzofuran-3-yl)propanamide Traditional Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(2-methoxydibenzofuran-3-yl)propionamide Formula: C31H24N4O3S MolecularWeight: 532.61226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C2C3=CC=CC=C3OC2=C1)OC)SC4=NC(=C(N=N4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C(=O)NC1=C(C=C2C3=CC=CC=C3OC2=C1)OC)SC4=NC(=C(N=N4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H24N4O3S/c1-19(30(36)32-24-18-26-23(17-27(24)37-2)22-15-9-10-16-25(22)38-26)39-31-33-28(20-11-5-3-6-12-20)29(34-35-31)21-13-7-4-8-14-21/h3-19H,1-2H3,(H,32,36)