methyl 1-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]cyclohexanecarboxylate CAS Name: 1-[[(3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolyl)-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carbonyl)amino]cyclohexane-1-carboxylate Traditional Name: 1-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]cyclohexanecarboxylic acid methyl ester Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NC3(CCCCC3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NC3(CCCCC3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O3S/c1-14-16-13-17(28-19(16)24(23-14)15-9-5-3-6-10-15)18(25)22-21(20(26)27-2)11-7-4-8-12-21/h3,5-6,9-10,13H,4,7-8,11-12H2,1-2H3,(H,22,25)