[4-(4-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-phenylquinolin-4-yl)methanone

Systemtic Name: [4-(4-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-phenylquinolin-4-yl)methanone Openeye Name: [4-(4-chloro-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-phenyl-4-quinolyl)methanone CAS Name: [4-(4-chloro-1,3-benzothiazol-2-yl)-1-piperazinyl]-(2-phenyl-4-quinolinyl)methanone IUPAC Name: [4-(4-chloro-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-phenylquinolin-4-yl)methanone Traditional Name: [4-(4-chloro-1,3-benzothiazol-2-yl)piperazino]-(2-phenyl-4-quinolyl)methanone Formula: C27H21ClN4OS MolecularWeight: 484.99984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=CC=C3Cl)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=CC=C3Cl)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C27H21ClN4OS/c28-21-10-6-12-24-25(21)30-27(34-24)32-15-13-31(14-16-32)26(33)20-17-23(18-7-2-1-3-8-18)29-22-11-5-4-9-19(20)22/h1-12,17H,13-16H2