N-[(6-chloranyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[(6-chloranyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[(6-chloro-2-phenyl-benzotriazol-5-yl)carbamothioyl]benzamide CAS Name: N-[[(6-chloro-2-phenyl-5-benzotriazolyl)amino]-sulfanylidenemethyl]-3-phenylmethoxybenzamide IUPAC Name: N-[(6-chloro-2-phenylbenzotriazol-5-yl)carbamothioyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[(6-chloro-2-phenyl-benzotriazol-5-yl)thiocarbamoyl]benzamide Formula: C27H20ClN5O2S MolecularWeight: 513.998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=CC4=NN(N=C4C=C3Cl)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)NC(=S)NC3=CC4=NN(N=C4C=C3Cl)C5=CC=CC=C5

InChI

InChI=1S/C27H20ClN5O2S/c28-22-15-24-25(32-33(31-24)20-11-5-2-6-12-20)16-23(22)29-27(36)30-26(34)19-10-7-13-21(14-19)35-17-18-8-3-1-4-9-18/h1-16H,17H2,(H2,29,30,34,36)