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

Systemtic Name: 1-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitro-pyrrole-2-carboxamide Openeye Name: 1-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitro-pyrrole-2-carboxamide CAS Name: 1-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitro-2-pyrrolecarboxamide IUPAC Name: 1-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitropyrrole-2-carboxamide Traditional Name: 1-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitro-pyrrole-2-carboxamide Formula: C14H12N4O3S MolecularWeight: 316.33508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CN3C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O3S/c1-8-3-4-10-12(5-8)22-14(15-10)16-13(19)11-6-9(18(20)21)7-17(11)2/h3-7H,1-2H3,(H,15,16,19)