3-(3-chlorophenyl)-4-(3-phenoxy-2-pyrrolidin-1-yl-propyl)-2,3-dihydro-1,4-benzothiazine

Systemtic Name: 3-(3-chlorophenyl)-4-(3-phenoxy-2-pyrrolidin-1-yl-propyl)-2,3-dihydro-1,4-benzothiazine Openeye Name: 3-(3-chlorophenyl)-4-(3-phenoxy-2-pyrrolidin-1-yl-propyl)-2,3-dihydro-1,4-benzothiazine CAS Name: 3-(3-chlorophenyl)-4-[3-phenoxy-2-(1-pyrrolidinyl)propyl]-2,3-dihydro-1,4-benzothiazine IUPAC Name: 3-(3-chlorophenyl)-4-(3-phenoxy-2-pyrrolidin-1-ylpropyl)-2,3-dihydro-1,4-benzothiazine Traditional Name: 3-(3-chlorophenyl)-4-(3-phenoxy-2-pyrrolidino-propyl)-2,3-dihydro-1,4-benzothiazine Formula: C27H29ClN2OS MolecularWeight: 465.04996

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CN2C(CSC3=CC=CC=C32)C4=CC(=CC=C4)Cl)COC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(CN2C(CSC3=CC=CC=C32)C4=CC(=CC=C4)Cl)COC5=CC=CC=C5

InChI

InChI=1S/C27H29ClN2OS/c28-22-10-8-9-21(17-22)26-20-32-27-14-5-4-13-25(27)30(26)18-23(29-15-6-7-16-29)19-31-24-11-2-1-3-12-24/h1-5,8-14,17,23,26H,6-7,15-16,18-20H2