N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-(2-thienyl)pyrazole-4-carboxamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCNC(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCNC(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C25H23N3O3S/c29-25(26-11-10-18-8-9-21-22(15-18)31-13-12-30-21)20-17-28(16-19-5-2-1-3-6-19)27-24(20)23-7-4-14-32-23/h1-9,14-15,17H,10-13,16H2,(H,26,29)