3-(3-methoxyphenyl)-4-[3-(2-methylpropoxy)-2-pyrrolidin-1-yl-propyl]-2,3-dihydro-1,4-benzothiazine

Systemtic Name: 3-(3-methoxyphenyl)-4-[3-(2-methylpropoxy)-2-pyrrolidin-1-yl-propyl]-2,3-dihydro-1,4-benzothiazine Openeye Name: 4-(3-isobutoxy-2-pyrrolidin-1-yl-propyl)-3-(3-methoxyphenyl)-2,3-dihydro-1,4-benzothiazine CAS Name: 3-(3-methoxyphenyl)-4-[3-(2-methylpropoxy)-2-(1-pyrrolidinyl)propyl]-2,3-dihydro-1,4-benzothiazine IUPAC Name: 3-(3-methoxyphenyl)-4-[3-(2-methylpropoxy)-2-pyrrolidin-1-ylpropyl]-2,3-dihydro-1,4-benzothiazine Traditional Name: 4-(3-isobutoxy-2-pyrrolidino-propyl)-3-(3-methoxyphenyl)-2,3-dihydro-1,4-benzothiazine Formula: C26H36N2O2S MolecularWeight: 440.64124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCC(CN1C(CSC2=CC=CC=C21)C3=CC(=CC=C3)OC)N4CCCC4

Isomeric SMILES

CC(C)COCC(CN1C(CSC2=CC=CC=C21)C3=CC(=CC=C3)OC)N4CCCC4

InChI

InChI=1S/C26H36N2O2S/c1-20(2)17-30-18-22(27-13-6-7-14-27)16-28-24-11-4-5-12-26(24)31-19-25(28)21-9-8-10-23(15-21)29-3/h4-5,8-12,15,20,22,25H,6-7,13-14,16-19H2,1-3H3