(3S,5S)-3-(1,3-benzothiazol-2-ylmethyl)-5-(3-cyclopentyloxy-4-methoxy-phenyl)piperidin-2-one

Systemtic Name: (3S,5S)-3-(1,3-benzothiazol-2-ylmethyl)-5-(3-cyclopentyloxy-4-methoxy-phenyl)piperidin-2-one Openeye Name: (3S,5S)-3-(1,3-benzothiazol-2-ylmethyl)-5-[3-(cyclopentoxy)-4-methoxy-phenyl]piperidin-2-one CAS Name: (3S,5S)-3-(1,3-benzothiazol-2-ylmethyl)-5-(3-cyclopentyloxy-4-methoxyphenyl)-2-piperidinone IUPAC Name: (3S,5S)-3-(1,3-benzothiazol-2-ylmethyl)-5-(3-cyclopentyloxy-4-methoxyphenyl)piperidin-2-one Traditional Name: (3S,5S)-3-(1,3-benzothiazol-2-ylmethyl)-5-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-piperidone Formula: C25H28N2O3S MolecularWeight: 436.56642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(C(=O)NC2)CC3=NC4=CC=CC=C4S3)OC5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2C[C@H](C(=O)NC2)CC3=NC4=CC=CC=C4S3)OC5CCCC5

InChI

InChI=1S/C25H28N2O3S/c1-29-21-11-10-16(13-22(21)30-19-6-2-3-7-19)18-12-17(25(28)26-15-18)14-24-27-20-8-4-5-9-23(20)31-24/h4-5,8-11,13,17-19H,2-3,6-7,12,14-15H2,1H3,(H,26,28)/t17-,18+/m0/s1