N-[1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-5-ethanoyl-thiophene-3-carboxamide

Systemtic Name: N-[1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-5-ethanoyl-thiophene-3-carboxamide Openeye Name: 5-acetyl-N-[1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]thiophene-3-carboxamide CAS Name: 5-acetyl-N-[1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]-3-thiophenecarboxamide IUPAC Name: 5-acetyl-N-[1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]thiophene-3-carboxamide Traditional Name: 5-acetyl-N-[1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]thiophene-3-carboxamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C3=C(C=N2)C(CCC3)NC(=O)C4=CSC(=C4)C(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C3=C(C=N2)C(CCC3)NC(=O)C4=CSC(=C4)C(=O)C)C

InChI

InChI=1S/C22H23N3O2S/c1-13-7-14(2)9-17(8-13)25-20-6-4-5-19(18(20)11-23-25)24-22(27)16-10-21(15(3)26)28-12-16/h7-12,19H,4-6H2,1-3H3,(H,24,27)