5-chloranyl-N-[(6-methyl-2-naphthalen-1-yl-benzotriazol-5-yl)carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-chloranyl-N-[(6-methyl-2-naphthalen-1-yl-benzotriazol-5-yl)carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-chloro-N-[[6-methyl-2-(1-naphthyl)benzotriazol-5-yl]carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-chloro-N-[[[6-methyl-2-(1-naphthalenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-chloro-N-[(6-methyl-2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-chloro-N-[[6-methyl-2-(1-naphthyl)benzotriazol-5-yl]thiocarbamoyl]-1-naphthamide Formula: C29H20ClN5OS MolecularWeight: 522.02

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Cl)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Cl)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C29H20ClN5OS/c1-17-15-25-26(34-35(33-25)27-14-4-8-18-7-2-3-9-19(18)27)16-24(17)31-29(37)32-28(36)22-12-5-11-21-20(22)10-6-13-23(21)30/h2-16H,1H3,(H2,31,32,36,37)