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

Systemtic Name: 3,4-dimethyl-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]benzamide Openeye Name: 3,4-dimethyl-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]benzamide CAS Name: 3,4-dimethyl-N-[[(2-phenyl-5-benzotriazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4-dimethyl-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]benzamide Traditional Name: 3,4-dimethyl-N-[(2-phenylbenzotriazol-5-yl)thiocarbamoyl]benzamide Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=CC=C4)C

InChI

InChI=1S/C22H19N5OS/c1-14-8-9-16(12-15(14)2)21(28)24-22(29)23-17-10-11-19-20(13-17)26-27(25-19)18-6-4-3-5-7-18/h3-13H,1-2H3,(H2,23,24,28,29)