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

Systemtic Name: [4-[4-(4-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]-phenyl-methanone Openeye Name: [4-[4-(4-chloro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]-phenyl-methanone CAS Name: [4-[[4-(4-chloro-1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]phenyl]-phenylmethanone IUPAC Name: [4-[4-(4-chloro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]-phenylmethanone Traditional Name: [4-[4-(4-chloro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]-phenyl-methanone Formula: C25H20ClN3O2S MolecularWeight: 461.9632

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=CC=C3Cl)C(=O)C4=CC=C(C=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=CC=C3Cl)C(=O)C4=CC=C(C=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H20ClN3O2S/c26-20-7-4-8-21-22(20)27-25(32-21)29-15-13-28(14-16-29)24(31)19-11-9-18(10-12-19)23(30)17-5-2-1-3-6-17/h1-12H,13-16H2