10-[1-(diethylamino)propan-2-yl]-N'-(phenylmethyl)phenothiazine-2-carboximidamide dihydrochloride

Systemtic Name: 10-[1-(diethylamino)propan-2-yl]-N'-(phenylmethyl)phenothiazine-2-carboximidamide dihydrochloride Openeye Name: N'-benzyl-10-[2-(diethylamino)-1-methyl-ethyl]phenothiazine-2-carboxamidine dihydrochloride CAS Name: 10-[1-(diethylamino)propan-2-yl]-N'-(phenylmethyl)-2-phenothiazinecarboximidamide dihydrochloride IUPAC Name: N'-benzyl-10-[1-(diethylamino)propan-2-yl]phenothiazine-2-carboximidamide dihydrochloride Traditional Name: N'-benzyl-10-[2-(diethylamino)-1-methyl-ethyl]phenothiazine-2-carboxamidine dihydrochloride Formula: C27H34Cl2N4S MolecularWeight: 517.55666

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(C)N1C2=CC=CC=C2SC3=C1C=C(C=C3)C(=NCC4=CC=CC=C4)N.Cl.Cl

Isomeric SMILES

CCN(CC)CC(C)N1C2=CC=CC=C2SC3=C1C=C(C=C3)C(=NCC4=CC=CC=C4)N.Cl.Cl

InChI

InChI=1S/C27H32N4S.2ClH/c1-4-30(5-2)19-20(3)31-23-13-9-10-14-25(23)32-26-16-15-22(17-24(26)31)27(28)29-18-21-11-7-6-8-12-21;;/h6-17,20H,4-5,18-19H2,1-3H3,(H2,28,29);2*1H