N-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-1-methyl-thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-1-methyl-thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-1-methyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-1-methyl-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-1-methylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-(3-methoxyphenyl)-1-methyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(S2)C(=O)NC3=CC4=C(C=C3)OCO4)C(=N1)C5=CC(=CC=C5)OC

Isomeric SMILES

CN1C2=C(C=C(S2)C(=O)NC3=CC4=C(C=C3)OCO4)C(=N1)C5=CC(=CC=C5)OC

InChI

InChI=1S/C21H17N3O4S/c1-24-21-15(19(23-24)12-4-3-5-14(8-12)26-2)10-18(29-21)20(25)22-13-6-7-16-17(9-13)28-11-27-16/h3-10H,11H2,1-2H3,(H,22,25)