3-(1,3-benzothiazol-2-yl)-1-[(2R)-2-(3-methoxyphenyl)pyrrolidin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-1-[(2R)-2-(3-methoxyphenyl)pyrrolidin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-1-[(2R)-2-(3-methoxyphenyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-(1,3-benzothiazol-2-yl)-1-[(2R)-2-(3-methoxyphenyl)-1-pyrrolidinyl]-1-propanone IUPAC Name: 3-(1,3-benzothiazol-2-yl)-1-[(2R)-2-(3-methoxyphenyl)pyrrolidin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-1-[(2R)-2-(3-methoxyphenyl)pyrrolidino]propan-1-one Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CCCN2C(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=CC(=C1)[C@H]2CCCN2C(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H22N2O2S/c1-25-16-7-4-6-15(14-16)18-9-5-13-23(18)21(24)12-11-20-22-17-8-2-3-10-19(17)26-20/h2-4,6-8,10,14,18H,5,9,11-13H2,1H3/t18-/m1/s1