2-(4-chlorophenyl)-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenyl)-N-[[2-(1-naphthyl)benzotriazol-5-yl]carbamothioyl]acetamide CAS Name: 2-(4-chlorophenyl)-N-[[[2-(1-naphthalenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenyl)-N-[[2-(1-naphthyl)benzotriazol-5-yl]thiocarbamoyl]acetamide Formula: C25H18ClN5OS MolecularWeight: 471.96132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2N3N=C4C=CC(=CC4=N3)NC(=S)NC(=O)CC5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N3N=C4C=CC(=CC4=N3)NC(=S)NC(=O)CC5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H18ClN5OS/c26-18-10-8-16(9-11-18)14-24(32)28-25(33)27-19-12-13-21-22(15-19)30-31(29-21)23-7-3-5-17-4-1-2-6-20(17)23/h1-13,15H,14H2,(H2,27,28,32,33)