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

Systemtic Name: N-(cyclobutylmethyl)-10-(1-pyrrolidin-1-ylpropan-2-yl)phenothiazine-2-carbothioamide Openeye Name: N-(cyclobutylmethyl)-10-(1-methyl-2-pyrrolidin-1-yl-ethyl)phenothiazine-2-carbothioamide CAS Name: N-(cyclobutylmethyl)-10-[1-(1-pyrrolidinyl)propan-2-yl]-2-phenothiazinecarbothioamide IUPAC Name: N-(cyclobutylmethyl)-10-(1-pyrrolidin-1-ylpropan-2-yl)phenothiazine-2-carbothioamide Traditional Name: N-(cyclobutylmethyl)-10-(1-methyl-2-pyrrolidino-ethyl)phenothiazine-2-carbothioamide Formula: C25H31N3S2 MolecularWeight: 437.66374

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCCC1)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=S)NCC5CCC5

Isomeric SMILES

CC(CN1CCCC1)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=S)NCC5CCC5

InChI

InChI=1S/C25H31N3S2/c1-18(17-27-13-4-5-14-27)28-21-9-2-3-10-23(21)30-24-12-11-20(15-22(24)28)25(29)26-16-19-7-6-8-19/h2-3,9-12,15,18-19H,4-8,13-14,16-17H2,1H3,(H,26,29)