2-[4-(4-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylbenzo[f]chromen-3-one

Systemtic Name: 2-[4-(4-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylbenzo[f]chromen-3-one Openeye Name: 2-[4-(4-chloro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzo[f]chromen-3-one CAS Name: 2-[[4-(4-chloro-1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]-3-benzo[f][1]benzopyranone IUPAC Name: 2-[4-(4-chloro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzo[f]chromen-3-one Traditional Name: 2-[4-(4-chloro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzo[f]chromen-3-one Formula: C25H18ClN3O3S MolecularWeight: 475.94672

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=CC=C3Cl)C(=O)C4=CC5=C(C=CC6=CC=CC=C65)OC4=O

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=CC=C3Cl)C(=O)C4=CC5=C(C=CC6=CC=CC=C65)OC4=O

InChI

InChI=1S/C25H18ClN3O3S/c26-19-6-3-7-21-22(19)27-25(33-21)29-12-10-28(11-13-29)23(30)18-14-17-16-5-2-1-4-15(16)8-9-20(17)32-24(18)31/h1-9,14H,10-13H2