N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-methyl-4-nitro-pyrrole-2-carboxamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-methyl-4-nitro-pyrrole-2-carboxamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-1-methyl-4-nitro-pyrrole-2-carboxamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-1-methyl-4-nitro-2-pyrrolecarboxamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-methyl-4-nitropyrrole-2-carboxamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-1-methyl-4-nitro-pyrrole-2-carboxamide Formula: C16H12N4O5S MolecularWeight: 372.35528

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O5S/c1-19-6-10(20(22)23)5-12(19)15(21)18-16-17-11(7-26-16)9-2-3-13-14(4-9)25-8-24-13/h2-7H,8H2,1H3,(H,17,18,21)