4-(1,3-benzothiazol-2-yl)-1-[4-(4-methoxyphenyl)carbonylpiperidin-1-yl]butan-1-one

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-1-[4-(4-methoxyphenyl)carbonylpiperidin-1-yl]butan-1-one Openeye Name: 4-(1,3-benzothiazol-2-yl)-1-[4-(4-methoxybenzoyl)-1-piperidyl]butan-1-one CAS Name: 4-(1,3-benzothiazol-2-yl)-1-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperidinyl]-1-butanone IUPAC Name: 4-(1,3-benzothiazol-2-yl)-1-[4-(4-methoxybenzoyl)piperidin-1-yl]butan-1-one Traditional Name: 4-(1,3-benzothiazol-2-yl)-1-(4-p-anisoylpiperidino)butan-1-one Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H26N2O3S/c1-29-19-11-9-17(10-12-19)24(28)18-13-15-26(16-14-18)23(27)8-4-7-22-25-20-5-2-3-6-21(20)30-22/h2-3,5-6,9-12,18H,4,7-8,13-16H2,1H3