N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-6-yl]-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-6-yl]-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-6-yl]-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[2-[[cyclohexyl(oxo)methyl]amino]-1,3-benzothiazol-6-yl]-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-6-yl]-2,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-6-yl]-2,5-dimethyl-pyrazole-3-carboxamide Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4CCCCC4)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)NC(=O)C4CCCCC4)C

InChI

InChI=1S/C20H23N5O2S/c1-12-10-16(25(2)24-12)19(27)21-14-8-9-15-17(11-14)28-20(22-15)23-18(26)13-6-4-3-5-7-13/h8-11,13H,3-7H2,1-2H3,(H,21,27)(H,22,23,26)