N-[(2,6-dimethoxyphenyl)methyl]-3-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)-N-methyl-propan-1-amine

Systemtic Name: N-[(2,6-dimethoxyphenyl)methyl]-3-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)-N-methyl-propan-1-amine Openeye Name: N-[(2,6-dimethoxyphenyl)methyl]-3-(1,2-dimethyl-5-oxo-phenothiazin-10-yl)-N-methyl-propan-1-amine CAS Name: N-[(2,6-dimethoxyphenyl)methyl]-3-(1,2-dimethyl-5-oxo-10-phenothiazinyl)-N-methyl-1-propanamine IUPAC Name: N-[(2,6-dimethoxyphenyl)methyl]-3-(1,2-dimethyl-5-oxophenothiazin-10-yl)-N-methylpropan-1-amine Traditional Name: (2,6-dimethoxybenzyl)-[3-(5-keto-1,2-dimethyl-phenothiazin-10-yl)propyl]-methyl-amine Formula: C27H32N2O3S MolecularWeight: 464.61958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCN(C)CC4=C(C=CC=C4OC)OC)C

Isomeric SMILES

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCN(C)CC4=C(C=CC=C4OC)OC)C

InChI

InChI=1S/C27H32N2O3S/c1-19-14-15-26-27(20(19)2)29(22-10-6-7-13-25(22)33(26)30)17-9-16-28(3)18-21-23(31-4)11-8-12-24(21)32-5/h6-8,10-15H,9,16-18H2,1-5H3