10-[1-(2,5-dihydropyrrol-1-yl)propyl]phenothiazine-2-carbothioamide

Systemtic Name: 10-[1-(2,5-dihydropyrrol-1-yl)propyl]phenothiazine-2-carbothioamide Openeye Name: 10-[1-(2,5-dihydropyrrol-1-yl)propyl]phenothiazine-2-carbothioamide CAS Name: 10-[1-(2,5-dihydropyrrol-1-yl)propyl]-2-phenothiazinecarbothioamide IUPAC Name: 10-[1-(2,5-dihydropyrrol-1-yl)propyl]phenothiazine-2-carbothioamide Traditional Name: 10-[1-(3-pyrrolin-1-yl)propyl]phenothiazine-2-carbothioamide Formula: C20H21N3S2 MolecularWeight: 367.53084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1CC=CC1)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=S)N

Isomeric SMILES

CCC(N1CC=CC1)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(=S)N

InChI

InChI=1S/C20H21N3S2/c1-2-19(22-11-5-6-12-22)23-15-7-3-4-8-17(15)25-18-10-9-14(20(21)24)13-16(18)23/h3-10,13,19H,2,11-12H2,1H3,(H2,21,24)