ethyl N-[10-(4-methylpiperazin-1-yl)carbonylphenothiazin-2-yl]carbamate dihydrochloride

Systemtic Name: ethyl N-[10-(4-methylpiperazin-1-yl)carbonylphenothiazin-2-yl]carbamate dihydrochloride Openeye Name: ethyl N-[10-(4-methylpiperazine-1-carbonyl)phenothiazin-2-yl]carbamate dihydrochloride CAS Name: N-[10-[(4-methyl-1-piperazinyl)-oxomethyl]-2-phenothiazinyl]carbamic acid ethyl ester dihydrochloride IUPAC Name: ethyl N-[10-(4-methylpiperazine-1-carbonyl)phenothiazin-2-yl]carbamate dihydrochloride Traditional Name: N-[10-(4-methylpiperazine-1-carbonyl)phenothiazin-2-yl]carbamic acid ethyl ester dihydrochloride Formula: C21H26Cl2N4O3S MolecularWeight: 485.42714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3N2C(=O)N4CCN(CC4)C.Cl.Cl

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3N2C(=O)N4CCN(CC4)C.Cl.Cl

InChI

InChI=1S/C21H24N4O3S.2ClH/c1-3-28-20(26)22-15-8-9-19-17(14-15)25(16-6-4-5-7-18(16)29-19)21(27)24-12-10-23(2)11-13-24;;/h4-9,14H,3,10-13H2,1-2H3,(H,22,26);2*1H