N-(2-methylbutyl)-10-(1-pyrrolidin-1-ylpropan-2-yl)phenothiazine-2-carbothioamide hydrochloride

Systemtic Name: N-(2-methylbutyl)-10-(1-pyrrolidin-1-ylpropan-2-yl)phenothiazine-2-carbothioamide hydrochloride Openeye Name: N-(2-methylbutyl)-10-(1-methyl-2-pyrrolidin-1-yl-ethyl)phenothiazine-2-carbothioamide hydrochloride CAS Name: N-(2-methylbutyl)-10-[1-(1-pyrrolidinyl)propan-2-yl]-2-phenothiazinecarbothioamide hydrochloride IUPAC Name: N-(2-methylbutyl)-10-(1-pyrrolidin-1-ylpropan-2-yl)phenothiazine-2-carbothioamide hydrochloride Traditional Name: N-(2-methylbutyl)-10-(1-methyl-2-pyrrolidino-ethyl)phenothiazine-2-carbothioamide hydrochloride Formula: C25H34ClN3S2 MolecularWeight: 476.14056

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC(=S)C1=CC2=C(C=C1)SC3=CC=CC=C3N2C(C)CN4CCCC4.Cl

Isomeric SMILES

CCC(C)CNC(=S)C1=CC2=C(C=C1)SC3=CC=CC=C3N2C(C)CN4CCCC4.Cl

InChI

InChI=1S/C25H33N3S2.ClH/c1-4-18(2)16-26-25(29)20-11-12-24-22(15-20)28(19(3)17-27-13-7-8-14-27)21-9-5-6-10-23(21)30-24;/h5-6,9-12,15,18-19H,4,7-8,13-14,16-17H2,1-3H3,(H,26,29);1H