[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-methoxy-4-methyl-phenyl)methanone

Systemtic Name: [4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-methoxy-4-methyl-phenyl)methanone Openeye Name: [4-(5-chloro-1,3-benzothiazol-2-yl)-1-piperidyl]-(3-methoxy-4-methyl-phenyl)methanone CAS Name: [4-(5-chloro-1,3-benzothiazol-2-yl)-1-piperidinyl]-(3-methoxy-4-methylphenyl)methanone IUPAC Name: [4-(5-chloro-1,3-benzothiazol-2-yl)piperidin-1-yl]-(3-methoxy-4-methylphenyl)methanone Traditional Name: [4-(5-chloro-1,3-benzothiazol-2-yl)piperidino]-(3-methoxy-4-methyl-phenyl)methanone Formula: C21H21ClN2O2S MolecularWeight: 400.92164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=NC4=C(S3)C=CC(=C4)Cl)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=NC4=C(S3)C=CC(=C4)Cl)OC

InChI

InChI=1S/C21H21ClN2O2S/c1-13-3-4-15(11-18(13)26-2)21(25)24-9-7-14(8-10-24)20-23-17-12-16(22)5-6-19(17)27-20/h3-6,11-12,14H,7-10H2,1-2H3