1-[3-(3-methoxyphenyl)-2,3-dihydro-1,4-benzothiazin-4-yl]-5-methyl-2-pyrrolidin-1-yl-hex-5-en-1-ol

Systemtic Name: 1-[3-(3-methoxyphenyl)-2,3-dihydro-1,4-benzothiazin-4-yl]-5-methyl-2-pyrrolidin-1-yl-hex-5-en-1-ol Openeye Name: 1-[3-(3-methoxyphenyl)-2,3-dihydro-1,4-benzothiazin-4-yl]-5-methyl-2-pyrrolidin-1-yl-hex-5-en-1-ol CAS Name: 1-[3-(3-methoxyphenyl)-2,3-dihydro-1,4-benzothiazin-4-yl]-5-methyl-2-(1-pyrrolidinyl)-5-hexen-1-ol IUPAC Name: 1-[3-(3-methoxyphenyl)-2,3-dihydro-1,4-benzothiazin-4-yl]-5-methyl-2-pyrrolidin-1-ylhex-5-en-1-ol Traditional Name: 1-[3-(3-methoxyphenyl)-2,3-dihydro-1,4-benzothiazin-4-yl]-5-methyl-2-pyrrolidino-hex-5-en-1-ol Formula: C26H34N2O2S MolecularWeight: 438.62536

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CCC(C(N1C(CSC2=CC=CC=C21)C3=CC(=CC=C3)OC)O)N4CCCC4

Isomeric SMILES

CC(=C)CCC(C(N1C(CSC2=CC=CC=C21)C3=CC(=CC=C3)OC)O)N4CCCC4

InChI

InChI=1S/C26H34N2O2S/c1-19(2)13-14-23(27-15-6-7-16-27)26(29)28-22-11-4-5-12-25(22)31-18-24(28)20-9-8-10-21(17-20)30-3/h4-5,8-12,17,23-24,26,29H,1,6-7,13-16,18H2,2-3H3