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

Systemtic Name: 3-chloranyl-4-(3-nitrophenyl)-1-[3-(phenothiazin-10-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]azetidin-2-one Openeye Name: 3-chloro-4-(3-nitrophenyl)-1-[3-(phenothiazin-10-ylmethyl)-5-thioxo-1H-1,2,4-triazol-4-yl]azetidin-2-one CAS Name: 3-chloro-4-(3-nitrophenyl)-1-[3-(10-phenothiazinylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-2-azetidinone IUPAC Name: 3-chloro-4-(3-nitrophenyl)-1-[3-(phenothiazin-10-ylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]azetidin-2-one Traditional Name: 3-chloro-4-(3-nitrophenyl)-1-[3-(phenothiazin-10-ylmethyl)-5-thioxo-1H-1,2,4-triazol-4-yl]azetidin-2-one Formula: C24H17ClN6O3S2 MolecularWeight: 537.01318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CC4=NNC(=S)N4N5C(C(C5=O)Cl)C6=CC(=CC=C6)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CC4=NNC(=S)N4N5C(C(C5=O)Cl)C6=CC(=CC=C6)[N+](=O)[O-]

InChI

InChI=1S/C24H17ClN6O3S2/c25-21-22(14-6-5-7-15(12-14)31(33)34)30(23(21)32)29-20(26-27-24(29)35)13-28-16-8-1-3-10-18(16)36-19-11-4-2-9-17(19)28/h1-12,21-22H,13H2,(H,27,35)