3,4-dimethoxy-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]benzamide Openeye Name: 3,4-dimethoxy-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]benzamide CAS Name: 3,4-dimethoxy-N-[[(2-phenyl-5-benzotriazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]benzamide Traditional Name: 3,4-dimethoxy-N-[(2-phenylbenzotriazol-5-yl)thiocarbamoyl]benzamide Formula: C22H19N5O3S MolecularWeight: 433.48296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=CC=C4)OC

InChI

InChI=1S/C22H19N5O3S/c1-29-19-11-8-14(12-20(19)30-2)21(28)24-22(31)23-15-9-10-17-18(13-15)26-27(25-17)16-6-4-3-5-7-16/h3-13H,1-2H3,(H2,23,24,28,31)