1,3-benzothiazol-2-yl-[1-(3,4-dimethoxyphenyl)carbonylpiperidin-4-yl]methanone

Systemtic Name: 1,3-benzothiazol-2-yl-[1-(3,4-dimethoxyphenyl)carbonylpiperidin-4-yl]methanone Openeye Name: 1,3-benzothiazol-2-yl-[1-(3,4-dimethoxybenzoyl)-4-piperidyl]methanone CAS Name: 1,3-benzothiazol-2-yl-[1-[(3,4-dimethoxyphenyl)-oxomethyl]-4-piperidinyl]methanone IUPAC Name: 1,3-benzothiazol-2-yl-[1-(3,4-dimethoxybenzoyl)piperidin-4-yl]methanone Traditional Name: 1,3-benzothiazol-2-yl-(1-veratroyl-4-piperidyl)methanone Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C22H22N2O4S/c1-27-17-8-7-15(13-18(17)28-2)22(26)24-11-9-14(10-12-24)20(25)21-23-16-5-3-4-6-19(16)29-21/h3-8,13-14H,9-12H2,1-2H3