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

Systemtic Name: 3-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propionamide Formula: C27H23N5O2S2 MolecularWeight: 513.63382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCSC3=NC(=C(N=N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCSC3=NC(=C(N=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H23N5O2S2/c1-2-34-20-13-14-21-22(17-20)36-26(28-21)29-23(33)15-16-35-27-30-24(18-9-5-3-6-10-18)25(31-32-27)19-11-7-4-8-12-19/h3-14,17H,2,15-16H2,1H3,(H,28,29,33)