1-methyl-4-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyrrole-2-carboxamide Openeye Name: 1-methyl-4-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyrrole-2-carboxamide CAS Name: 1-methyl-4-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyrrole-2-carboxamide Traditional Name: 1-methyl-4-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyrrole-2-carboxamide Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=NC3=C(S2)CCCC3)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=NC3=C(S2)CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O3S/c1-16-7-8(17(19)20)6-10(16)12(18)15-13-14-9-4-2-3-5-11(9)21-13/h6-7H,2-5H2,1H3,(H,14,15,18)