[3-(1,3-benzothiazol-2-ylcarbonyl)-1-phenyl-pyrazol-4-yl]-naphthalen-2-yl-methanone

Systemtic Name: [3-(1,3-benzothiazol-2-ylcarbonyl)-1-phenyl-pyrazol-4-yl]-naphthalen-2-yl-methanone Openeye Name: [3-(1,3-benzothiazole-2-carbonyl)-1-phenyl-pyrazol-4-yl]-(2-naphthyl)methanone CAS Name: [3-[1,3-benzothiazol-2-yl(oxo)methyl]-1-phenyl-4-pyrazolyl]-(2-naphthalenyl)methanone IUPAC Name: [3-(1,3-benzothiazole-2-carbonyl)-1-phenylpyrazol-4-yl]-naphthalen-2-ylmethanone Traditional Name: [3-(1,3-benzothiazole-2-carbonyl)-1-phenyl-pyrazol-4-yl]-(2-naphthyl)methanone Formula: C28H17N3O2S MolecularWeight: 459.51848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)C3=NC4=CC=CC=C4S3)C(=O)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C(=O)C3=NC4=CC=CC=C4S3)C(=O)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C28H17N3O2S/c32-26(20-15-14-18-8-4-5-9-19(18)16-20)22-17-31(21-10-2-1-3-11-21)30-25(22)27(33)28-29-23-12-6-7-13-24(23)34-28/h1-17H