3-chloranyl-4-(4-dimethylaminophenyl)-1-[3-(phenothiazin-10-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]azetidin-2-one

Systemtic Name: 3-chloranyl-4-(4-dimethylaminophenyl)-1-[3-(phenothiazin-10-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]azetidin-2-one Openeye Name: 3-chloro-4-(4-dimethylaminophenyl)-1-[3-(phenothiazin-10-ylmethyl)-5-thioxo-1H-1,2,4-triazol-4-yl]azetidin-2-one CAS Name: 3-chloro-4-(4-dimethylaminophenyl)-1-[3-(10-phenothiazinylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-2-azetidinone IUPAC Name: 3-chloro-4-(4-dimethylaminophenyl)-1-[3-(phenothiazin-10-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]azetidin-2-one Traditional Name: 3-chloro-4-(4-dimethylaminophenyl)-1-[3-(phenothiazin-10-ylmethyl)-5-thioxo-1H-1,2,4-triazol-4-yl]azetidin-2-one Formula: C26H23ClN6OS2 MolecularWeight: 535.08342

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2C(C(=O)N2N3C(=NNC3=S)CN4C5=CC=CC=C5SC6=CC=CC=C64)Cl

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2C(C(=O)N2N3C(=NNC3=S)CN4C5=CC=CC=C5SC6=CC=CC=C64)Cl

InChI

InChI=1S/C26H23ClN6OS2/c1-30(2)17-13-11-16(12-14-17)24-23(27)25(34)33(24)32-22(28-29-26(32)35)15-31-18-7-3-5-9-20(18)36-21-10-6-4-8-19(21)31/h3-14,23-24H,15H2,1-2H3,(H,29,35)