5-chloranyl-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 5-chloro-N-[2-(2-thienylmethyl)pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 5-chloro-N-[2-(thiophen-2-ylmethyl)-3-pyrazolyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 5-chloro-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: 5-chloro-N-[2-(2-thenyl)pyrazol-3-yl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C17H14ClN3O3S MolecularWeight: 375.82936

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)C(=O)NC3=CC=NN3CC4=CC=CS4

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)C(=O)NC3=CC=NN3CC4=CC=CS4

InChI

InChI=1S/C17H14ClN3O3S/c18-13-8-11(9-14-16(13)24-6-5-23-14)17(22)20-15-3-4-19-21(15)10-12-2-1-7-25-12/h1-4,7-9H,5-6,10H2,(H,20,22)