1,3-benzothiazol-2-yl-[4-(3,4-dimethoxyphenyl)-1-ethyl-5-piperidin-1-yl-pyrrolidin-3-yl]methanone

Systemtic Name: 1,3-benzothiazol-2-yl-[4-(3,4-dimethoxyphenyl)-1-ethyl-5-piperidin-1-yl-pyrrolidin-3-yl]methanone Openeye Name: 1,3-benzothiazol-2-yl-[4-(3,4-dimethoxyphenyl)-1-ethyl-5-(1-piperidyl)pyrrolidin-3-yl]methanone CAS Name: 1,3-benzothiazol-2-yl-[4-(3,4-dimethoxyphenyl)-1-ethyl-5-(1-piperidinyl)-3-pyrrolidinyl]methanone IUPAC Name: 1,3-benzothiazol-2-yl-[4-(3,4-dimethoxyphenyl)-1-ethyl-5-piperidin-1-ylpyrrolidin-3-yl]methanone Traditional Name: 1,3-benzothiazol-2-yl-[4-(3,4-dimethoxyphenyl)-1-ethyl-5-piperidino-pyrrolidin-3-yl]methanone Formula: C27H33N3O3S MolecularWeight: 479.63422

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(C(C1N2CCCCC2)C3=CC(=C(C=C3)OC)OC)C(=O)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCN1CC(C(C1N2CCCCC2)C3=CC(=C(C=C3)OC)OC)C(=O)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H33N3O3S/c1-4-29-17-19(25(31)26-28-20-10-6-7-11-23(20)34-26)24(27(29)30-14-8-5-9-15-30)18-12-13-21(32-2)22(16-18)33-3/h6-7,10-13,16,19,24,27H,4-5,8-9,14-15,17H2,1-3H3