2,4-dimethoxy-N-[[4-(5-phenyl-1,2,3-triazol-1-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2,4-dimethoxy-N-[[4-(5-phenyl-1,2,3-triazol-1-yl)phenyl]carbamothioyl]benzamide Openeye Name: 2,4-dimethoxy-N-[[4-(5-phenyltriazol-1-yl)phenyl]carbamothioyl]benzamide CAS Name: 2,4-dimethoxy-N-[[4-(5-phenyl-1-triazolyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dimethoxy-N-[[4-(5-phenyltriazol-1-yl)phenyl]carbamothioyl]benzamide Traditional Name: 2,4-dimethoxy-N-[[4-(5-phenyltriazol-1-yl)phenyl]thiocarbamoyl]benzamide Formula: C24H21N5O3S MolecularWeight: 459.52024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3C(=CN=N3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3C(=CN=N3)C4=CC=CC=C4)OC

InChI

InChI=1S/C24H21N5O3S/c1-31-19-12-13-20(22(14-19)32-2)23(30)27-24(33)26-17-8-10-18(11-9-17)29-21(15-25-28-29)16-6-4-3-5-7-16/h3-15H,1-2H3,(H2,26,27,30,33)