2-[1-(1,3-benzothiazol-2-yl)-2-(3-nitro-4-pyrrolidin-1-yl-phenyl)ethenyl]-1,3-benzothiazole

Systemtic Name: 2-[1-(1,3-benzothiazol-2-yl)-2-(3-nitro-4-pyrrolidin-1-yl-phenyl)ethenyl]-1,3-benzothiazole Openeye Name: 2-[1-(1,3-benzothiazol-2-yl)-2-(3-nitro-4-pyrrolidin-1-yl-phenyl)vinyl]-1,3-benzothiazole CAS Name: 2-[1-(1,3-benzothiazol-2-yl)-2-[3-nitro-4-(1-pyrrolidinyl)phenyl]ethenyl]-1,3-benzothiazole IUPAC Name: 2-[1-(1,3-benzothiazol-2-yl)-2-(3-nitro-4-pyrrolidin-1-ylphenyl)ethenyl]-1,3-benzothiazole Traditional Name: 2-[1-(1,3-benzothiazol-2-yl)-2-(3-nitro-4-pyrrolidino-phenyl)vinyl]-1,3-benzothiazole Formula: C26H20N4O2S2 MolecularWeight: 484.5926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C=C(C3=NC4=CC=CC=C4S3)C5=NC6=CC=CC=C6S5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C=C(C3=NC4=CC=CC=C4S3)C5=NC6=CC=CC=C6S5)[N+](=O)[O-]

InChI

InChI=1S/C26H20N4O2S2/c31-30(32)22-16-17(11-12-21(22)29-13-5-6-14-29)15-18(25-27-19-7-1-3-9-23(19)33-25)26-28-20-8-2-4-10-24(20)34-26/h1-4,7-12,15-16H,5-6,13-14H2