6-methyl-1-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)-2-pyrrolidin-1-yl-heptan-1-ol

Systemtic Name: 6-methyl-1-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)-2-pyrrolidin-1-yl-heptan-1-ol Openeye Name: 6-methyl-1-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)-2-pyrrolidin-1-yl-heptan-1-ol CAS Name: 6-methyl-1-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)-2-(1-pyrrolidinyl)-1-heptanol IUPAC Name: 6-methyl-1-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)-2-pyrrolidin-1-ylheptan-1-ol Traditional Name: 6-methyl-1-(3-phenyl-2,3-dihydro-1,4-benzothiazin-4-yl)-2-pyrrolidino-heptan-1-ol Formula: C26H36N2OS MolecularWeight: 424.64184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C(N1C(CSC2=CC=CC=C21)C3=CC=CC=C3)O)N4CCCC4

Isomeric SMILES

CC(C)CCCC(C(N1C(CSC2=CC=CC=C21)C3=CC=CC=C3)O)N4CCCC4

InChI

InChI=1S/C26H36N2OS/c1-20(2)11-10-15-23(27-17-8-9-18-27)26(29)28-22-14-6-7-16-25(22)30-19-24(28)21-12-4-3-5-13-21/h3-7,12-14,16,20,23-24,26,29H,8-11,15,17-19H2,1-2H3