4-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-1-thiophen-2-yl-butan-1-one

Systemtic Name: 4-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-1-thiophen-2-yl-butan-1-one Openeye Name: 4-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-1-(2-thienyl)butan-1-one CAS Name: 4-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-1-thiophen-2-yl-1-butanone IUPAC Name: 4-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-1-thiophen-2-ylbutan-1-one Traditional Name: 4-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-1-(2-thienyl)butan-1-one Formula: C23H19N3OS2 MolecularWeight: 417.54646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NC(=N2)SCCCC(=O)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC(=N2)SCCCC(=O)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C23H19N3OS2/c27-19(20-14-8-15-28-20)13-7-16-29-23-24-21(17-9-3-1-4-10-17)22(25-26-23)18-11-5-2-6-12-18/h1-6,8-12,14-15H,7,13,16H2