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

Systemtic Name: [1-(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylpiperidin-4-yl]-(1,3-benzothiazol-2-yl)methanone Openeye Name: [1-(4-amino-5-chloro-2-methoxy-benzoyl)-4-piperidyl]-(1,3-benzothiazol-2-yl)methanone CAS Name: [1-[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]-4-piperidinyl]-(1,3-benzothiazol-2-yl)methanone IUPAC Name: [1-(4-amino-5-chloro-2-methoxybenzoyl)piperidin-4-yl]-(1,3-benzothiazol-2-yl)methanone Traditional Name: [1-(4-amino-5-chloro-2-methoxy-benzoyl)-4-piperidyl]-(1,3-benzothiazol-2-yl)methanone Formula: C21H20ClN3O3S MolecularWeight: 429.9198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)N2CCC(CC2)C(=O)C3=NC4=CC=CC=C4S3)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)N2CCC(CC2)C(=O)C3=NC4=CC=CC=C4S3)Cl)N

InChI

InChI=1S/C21H20ClN3O3S/c1-28-17-11-15(23)14(22)10-13(17)21(27)25-8-6-12(7-9-25)19(26)20-24-16-4-2-3-5-18(16)29-20/h2-5,10-12H,6-9,23H2,1H3