2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)propan-1-one

Systemtic Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)propan-1-one Openeye Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)propan-1-one CAS Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-1-(2-methyl-1H-indol-3-yl)-1-propanone IUPAC Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)propan-1-one Traditional Name: 2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-1-(2-methyl-1H-indol-3-yl)propan-1-one Formula: C27H22N4OS MolecularWeight: 450.55478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=NC(=C(N=N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=NC(=C(N=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H22N4OS/c1-17-23(21-15-9-10-16-22(21)28-17)26(32)18(2)33-27-29-24(19-11-5-3-6-12-19)25(30-31-27)20-13-7-4-8-14-20/h3-16,18,28H,1-2H3