1-(2-chloranylphenothiazin-10-yl)-2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(2-chloranylphenothiazin-10-yl)-2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(2-chlorophenothiazin-10-yl)-2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone CAS Name: 1-(2-chloro-10-phenothiazinyl)-2-[[4-cyclopropyl-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(2-chlorophenothiazin-10-yl)-2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(2-chlorophenothiazin-10-yl)-2-[(4-cyclopropyl-5-pyrrolidino-1,2,4-triazol-3-yl)thio]ethanone Formula: C23H22ClN5OS2 MolecularWeight: 484.03668

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(N2C3CC3)SCC(=O)N4C5=CC=CC=C5SC6=C4C=C(C=C6)Cl

Isomeric SMILES

C1CCN(C1)C2=NN=C(N2C3CC3)SCC(=O)N4C5=CC=CC=C5SC6=C4C=C(C=C6)Cl

InChI

InChI=1S/C23H22ClN5OS2/c24-15-7-10-20-18(13-15)29(17-5-1-2-6-19(17)32-20)21(30)14-31-23-26-25-22(27-11-3-4-12-27)28(23)16-8-9-16/h1-2,5-7,10,13,16H,3-4,8-9,11-12,14H2