N-(3-methylbutyl)-N-(1-pyrrolidin-1-ylpropan-2-yl)-10H-phenothiazine-2-carbothioamide hydrochloride

Systemtic Name: N-(3-methylbutyl)-N-(1-pyrrolidin-1-ylpropan-2-yl)-10H-phenothiazine-2-carbothioamide hydrochloride Openeye Name: N-isopentyl-N-(1-methyl-2-pyrrolidin-1-yl-ethyl)-10H-phenothiazine-2-carbothioamide hydrochloride CAS Name: N-(3-methylbutyl)-N-[1-(1-pyrrolidinyl)propan-2-yl]-10H-phenothiazine-2-carbothioamide hydrochloride IUPAC Name: N-(3-methylbutyl)-N-(1-pyrrolidin-1-ylpropan-2-yl)-10H-phenothiazine-2-carbothioamide hydrochloride Traditional Name: N-isoamyl-N-(1-methyl-2-pyrrolidino-ethyl)-10H-phenothiazine-2-carbothioamide hydrochloride Formula: C25H34ClN3S2 MolecularWeight: 476.14056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C(C)CN1CCCC1)C(=S)C2=CC3=C(C=C2)SC4=CC=CC=C4N3.Cl

Isomeric SMILES

CC(C)CCN(C(C)CN1CCCC1)C(=S)C2=CC3=C(C=C2)SC4=CC=CC=C4N3.Cl

InChI

InChI=1S/C25H33N3S2.ClH/c1-18(2)12-15-28(19(3)17-27-13-6-7-14-27)25(29)20-10-11-24-22(16-20)26-21-8-4-5-9-23(21)30-24;/h4-5,8-11,16,18-19,26H,6-7,12-15,17H2,1-3H3;1H