[4-(4-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,5-dimethoxyphenyl)methanone

Systemtic Name: [4-(4-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,5-dimethoxyphenyl)methanone Openeye Name: [4-(4-chloro-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,5-dimethoxyphenyl)methanone CAS Name: [4-(4-chloro-1,3-benzothiazol-2-yl)-1-piperazinyl]-(3,5-dimethoxyphenyl)methanone IUPAC Name: [4-(4-chloro-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3,5-dimethoxyphenyl)methanone Traditional Name: [4-(4-chloro-1,3-benzothiazol-2-yl)piperazino]-(3,5-dimethoxyphenyl)methanone Formula: C20H20ClN3O3S MolecularWeight: 417.9091

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=CC=C4Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=CC=C4Cl)OC

InChI

InChI=1S/C20H20ClN3O3S/c1-26-14-10-13(11-15(12-14)27-2)19(25)23-6-8-24(9-7-23)20-22-18-16(21)4-3-5-17(18)28-20/h3-5,10-12H,6-9H2,1-2H3