N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-nitro-1H-pyrrole-2-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-nitro-1H-pyrrole-2-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-nitro-1H-pyrrole-2-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-nitro-1H-pyrrole-2-carboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-nitro-1H-pyrrole-2-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-nitro-1H-pyrrole-2-carboxamide Formula: C18H12N4O3S MolecularWeight: 364.37788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=O)C4=CC(=CN4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=O)C4=CC(=CN4)[N+](=O)[O-]

InChI

InChI=1S/C18H12N4O3S/c23-17(15-9-13(10-19-15)22(24)25)20-12-5-3-4-11(8-12)18-21-14-6-1-2-7-16(14)26-18/h1-10,19H,(H,20,23)