1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-phenoxy-butan-1-one

Systemtic Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-phenoxy-butan-1-one Openeye Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-phenoxy-butan-1-one CAS Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-4-phenoxy-1-butanone IUPAC Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-phenoxybutan-1-one Traditional Name: 1-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-4-phenoxy-butan-1-one Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCCOC2=CC=CC=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)CCCOC2=CC=CC=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H22N2O2S/c24-20(13-7-15-25-16-8-2-1-3-9-16)23-14-6-11-18(23)21-22-17-10-4-5-12-19(17)26-21/h1-5,8-10,12,18H,6-7,11,13-15H2/t18-/m1/s1