(5R,6S)-6-(4-nitroimidazol-1-yl)-5-thiophen-2-yl-3-[(E)-2-thiophen-2-ylethenyl]cyclohex-2-en-1-one

Systemtic Name: (5R,6S)-6-(4-nitroimidazol-1-yl)-5-thiophen-2-yl-3-[(E)-2-thiophen-2-ylethenyl]cyclohex-2-en-1-one Openeye Name: (5R,6S)-6-(4-nitroimidazol-1-yl)-5-(2-thienyl)-3-[(E)-2-(2-thienyl)vinyl]cyclohex-2-en-1-one CAS Name: (5R,6S)-6-(4-nitro-1-imidazolyl)-5-thiophen-2-yl-3-[(E)-2-thiophen-2-ylethenyl]-1-cyclohex-2-enone IUPAC Name: (5R,6S)-6-(4-nitroimidazol-1-yl)-5-thiophen-2-yl-3-[(E)-2-thiophen-2-ylethenyl]cyclohex-2-en-1-one Traditional Name: (5R,6S)-6-(4-nitroimidazol-1-yl)-5-(2-thienyl)-3-[(E)-2-(2-thienyl)vinyl]cyclohex-2-en-1-one Formula: C19H15N3O3S2 MolecularWeight: 397.4707

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(=O)C=C1C=CC2=CC=CS2)N3C=C(N=C3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

C1[C@H]([C@@H](C(=O)C=C1/C=C/C2=CC=CS2)N3C=C(N=C3)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C19H15N3O3S2/c23-16-10-13(5-6-14-3-1-7-26-14)9-15(17-4-2-8-27-17)19(16)21-11-18(20-12-21)22(24)25/h1-8,10-12,15,19H,9H2/b6-5+/t15-,19-/m0/s1