N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-6-yl]-2-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-6-yl]-2-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-6-yl]-2-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[2-[[cyclohexyl(oxo)methyl]amino]-1,3-benzothiazol-6-yl]-2-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-6-yl]-2-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-6-yl]-2-methyl-4-nitro-pyrazole-3-carboxamide Formula: C19H20N6O4S MolecularWeight: 428.4649

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4CCCCC4

Isomeric SMILES

CN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4CCCCC4

InChI

InChI=1S/C19H20N6O4S/c1-24-16(14(10-20-24)25(28)29)18(27)21-12-7-8-13-15(9-12)30-19(22-13)23-17(26)11-5-3-2-4-6-11/h7-11H,2-6H2,1H3,(H,21,27)(H,22,23,26)