(E)-3-(4-nitrophenyl)-1-(3-phenyl-5-phenylazanyl-1,3,4-thiadiazol-3-ium-2-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-nitrophenyl)-1-(3-phenyl-5-phenylazanyl-1,3,4-thiadiazol-3-ium-2-yl)prop-2-en-1-one Openeye Name: (E)-1-(5-anilino-3-phenyl-1,3,4-thiadiazol-3-ium-2-yl)-3-(4-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-(5-anilino-3-phenyl-1,3,4-thiadiazol-3-ium-2-yl)-3-(4-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(5-anilino-3-phenyl-1,3,4-thiadiazol-3-ium-2-yl)-3-(4-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(5-anilino-3-phenyl-1,3,4-thiadiazol-3-ium-2-yl)-3-(4-nitrophenyl)prop-2-en-1-one Formula: C23H17N4O3S+ MolecularWeight: 429.47108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=N[N+](=C(S2)C(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)NC2=N[N+](=C(S2)C(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H16N4O3S/c28-21(16-13-17-11-14-20(15-12-17)27(29)30)22-26(19-9-5-2-6-10-19)25-23(31-22)24-18-7-3-1-4-8-18/h1-16H/p+1/b16-13+