N-[(6-chloranyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]-4-[(4-chlorophenyl)methoxy]-3-methoxy-benzamide

Systemtic Name: N-[(6-chloranyl-2-phenyl-benzotriazol-5-yl)carbamothioyl]-4-[(4-chlorophenyl)methoxy]-3-methoxy-benzamide Openeye Name: N-[(6-chloro-2-phenyl-benzotriazol-5-yl)carbamothioyl]-4-[(4-chlorophenyl)methoxy]-3-methoxy-benzamide CAS Name: N-[[(6-chloro-2-phenyl-5-benzotriazolyl)amino]-sulfanylidenemethyl]-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide IUPAC Name: N-[(6-chloro-2-phenylbenzotriazol-5-yl)carbamothioyl]-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide Traditional Name: 4-(4-chlorobenzyl)oxy-N-[(6-chloro-2-phenyl-benzotriazol-5-yl)thiocarbamoyl]-3-methoxy-benzamide Formula: C28H21Cl2N5O3S MolecularWeight: 578.46904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2Cl)C4=CC=CC=C4)OCC5=CC=C(C=C5)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2Cl)C4=CC=CC=C4)OCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H21Cl2N5O3S/c1-37-26-13-18(9-12-25(26)38-16-17-7-10-19(29)11-8-17)27(36)32-28(39)31-22-15-24-23(14-21(22)30)33-35(34-24)20-5-3-2-4-6-20/h2-15H,16H2,1H3,(H2,31,32,36,39)