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

Systemtic Name: 3-(3-chlorophenyl)-4-(3-phenylmethoxy-2-pyrrolidin-1-yl-propyl)-2,3-dihydro-1,4-benzothiazine Openeye Name: 4-(3-benzyloxy-2-pyrrolidin-1-yl-propyl)-3-(3-chlorophenyl)-2,3-dihydro-1,4-benzothiazine CAS Name: 3-(3-chlorophenyl)-4-[3-phenylmethoxy-2-(1-pyrrolidinyl)propyl]-2,3-dihydro-1,4-benzothiazine IUPAC Name: 3-(3-chlorophenyl)-4-(3-phenylmethoxy-2-pyrrolidin-1-ylpropyl)-2,3-dihydro-1,4-benzothiazine Traditional Name: 4-(3-benzoxy-2-pyrrolidino-propyl)-3-(3-chlorophenyl)-2,3-dihydro-1,4-benzothiazine Formula: C28H31ClN2OS MolecularWeight: 479.07654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CN2C(CSC3=CC=CC=C32)C4=CC(=CC=C4)Cl)COCC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(CN2C(CSC3=CC=CC=C32)C4=CC(=CC=C4)Cl)COCC5=CC=CC=C5

InChI

InChI=1S/C28H31ClN2OS/c29-24-12-8-11-23(17-24)27-21-33-28-14-5-4-13-26(28)31(27)18-25(30-15-6-7-16-30)20-32-19-22-9-2-1-3-10-22/h1-5,8-14,17,25,27H,6-7,15-16,18-21H2