3-(2-chloranyl-5-oxidanylidene-phenothiazin-10-yl)-N,N-dimethyl-propan-1-amine hydrate hydrochloride

Systemtic Name: 3-(2-chloranyl-5-oxidanylidene-phenothiazin-10-yl)-N,N-dimethyl-propan-1-amine hydrate hydrochloride Openeye Name: 3-(2-chloro-5-oxo-phenothiazin-10-yl)-N,N-dimethyl-propan-1-amine hydrate hydrochloride CAS Name: 3-(2-chloro-5-oxo-10-phenothiazinyl)-N,N-dimethyl-1-propanamine hydrate hydrochloride IUPAC Name: 3-(2-chloro-5-oxophenothiazin-10-yl)-N,N-dimethylpropan-1-amine hydrate hydrochloride Traditional Name: 3-(2-chloro-5-keto-phenothiazin-10-yl)propyl-dimethyl-amine hydrate hydrochloride Formula: C17H22Cl2N2O2S MolecularWeight: 389.33978

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2=CC=CC=C2S(=O)C3=C1C=C(C=C3)Cl.O.Cl

Isomeric SMILES

CN(C)CCCN1C2=CC=CC=C2S(=O)C3=C1C=C(C=C3)Cl.O.Cl

InChI

InChI=1S/C17H19ClN2OS.ClH.H2O/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)22(21)17-9-8-13(18)12-15(17)20;;/h3-4,6-9,12H,5,10-11H2,1-2H3;1H;1H2