2-[[3-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)propylamino]methyl]-6-propan-2-yloxy-phenol

Systemtic Name: 2-[[3-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)propylamino]methyl]-6-propan-2-yloxy-phenol Openeye Name: 2-[[3-(1,2-dimethyl-5-oxo-phenothiazin-10-yl)propylamino]methyl]-6-isopropoxy-phenol CAS Name: 2-[[3-(1,2-dimethyl-5-oxo-10-phenothiazinyl)propylamino]methyl]-6-propan-2-yloxyphenol IUPAC Name: 2-[[3-(1,2-dimethyl-5-oxophenothiazin-10-yl)propylamino]methyl]-6-propan-2-yloxyphenol Traditional Name: 2-isopropoxy-6-[[3-(5-keto-1,2-dimethyl-phenothiazin-10-yl)propylamino]methyl]phenol 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=C3N2CCCNCC4=C(C(=CC=C4)OC(C)C)O)C

Isomeric SMILES

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCNCC4=C(C(=CC=C4)OC(C)C)O)C

InChI

InChI=1S/C27H32N2O3S/c1-18(2)32-23-11-7-9-21(27(23)30)17-28-15-8-16-29-22-10-5-6-12-24(22)33(31)25-14-13-19(3)20(4)26(25)29/h5-7,9-14,18,28,30H,8,15-17H2,1-4H3