N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-phenothiazin-10-yl-prop-1-yn-1-amine

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-phenothiazin-10-yl-prop-1-yn-1-amine Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-phenothiazin-10-yl-prop-1-yn-1-amine CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-(10-phenothiazinyl)-1-propyn-1-amine IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-phenothiazin-10-ylprop-1-yn-1-amine Traditional Name: homoveratryl-methyl-(3-phenothiazin-10-ylprop-1-ynyl)amine Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C#CCN2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C#CCN2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C26H26N2O2S/c1-27(18-15-20-13-14-23(29-2)24(19-20)30-3)16-8-17-28-21-9-4-6-11-25(21)31-26-12-7-5-10-22(26)28/h4-7,9-14,19H,15,17-18H2,1-3H3