N-(cyclobutylmethyl)-10-(1-pyrrolidin-1-ylpropyl)phenothiazine-2-carbothioamide

Systemtic Name: N-(cyclobutylmethyl)-10-(1-pyrrolidin-1-ylpropyl)phenothiazine-2-carbothioamide Openeye Name: N-(cyclobutylmethyl)-10-(1-pyrrolidin-1-ylpropyl)phenothiazine-2-carbothioamide CAS Name: N-(cyclobutylmethyl)-10-[1-(1-pyrrolidinyl)propyl]-2-phenothiazinecarbothioamide IUPAC Name: N-(cyclobutylmethyl)-10-(1-pyrrolidin-1-ylpropyl)phenothiazine-2-carbothioamide Traditional Name: N-(cyclobutylmethyl)-10-(1-pyrrolidinopropyl)phenothiazine-2-carbothioamide Formula: C25H31N3S2 MolecularWeight: 437.66374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1CCCC1)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=S)NCC5CCC5

Isomeric SMILES

CCC(N1CCCC1)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=S)NCC5CCC5

InChI

InChI=1S/C25H31N3S2/c1-2-24(27-14-5-6-15-27)28-20-10-3-4-11-22(20)30-23-13-12-19(16-21(23)28)25(29)26-17-18-8-7-9-18/h3-4,10-13,16,18,24H,2,5-9,14-15,17H2,1H3,(H,26,29)