8-nitro-6-thiophen-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepine-1-carbaldehyde

Systemtic Name: 8-nitro-6-thiophen-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepine-1-carbaldehyde Openeye Name: 8-nitro-6-(2-thienyl)-4H-imidazo[1,2-a][1,4]benzodiazepine-1-carbaldehyde CAS Name: 8-nitro-6-thiophen-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepine-1-carboxaldehyde IUPAC Name: 8-nitro-6-thiophen-2-yl-4H-imidazo[1,2-a][1,4]benzodiazepine-1-carbaldehyde Traditional Name: 8-nitro-6-(2-thienyl)-4H-imidazo[1,2-a][1,4]benzodiazepine-1-carbaldehyde Formula: C16H10N4O3S MolecularWeight: 338.3406

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=NC=C(N2C3=C(C=C(C=C3)[N+](=O)[O-])C(=N1)C4=CC=CS4)C=O

Isomeric SMILES

C1C2=NC=C(N2C3=C(C=C(C=C3)[N+](=O)[O-])C(=N1)C4=CC=CS4)C=O

InChI

InChI=1S/C16H10N4O3S/c21-9-11-7-17-15-8-18-16(14-2-1-5-24-14)12-6-10(20(22)23)3-4-13(12)19(11)15/h1-7,9H,8H2