4-(1,3-benzodioxol-5-yloxy)-N-(thiophen-2-ylmethyl)pyrimidine-5-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-yloxy)-N-(thiophen-2-ylmethyl)pyrimidine-5-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-yloxy)-N-(2-thienylmethyl)pyrimidine-5-carboxamide CAS Name: 4-(1,3-benzodioxol-5-yloxy)-N-(thiophen-2-ylmethyl)-5-pyrimidinecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-yloxy)-N-(thiophen-2-ylmethyl)pyrimidine-5-carboxamide Traditional Name: 4-(1,3-benzodioxol-5-yloxy)-N-(2-thenyl)pyrimidine-5-carboxamide Formula: C17H13N3O4S MolecularWeight: 355.36782

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OC3=NC=NC=C3C(=O)NCC4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OC3=NC=NC=C3C(=O)NCC4=CC=CS4

InChI

InChI=1S/C17H13N3O4S/c21-16(19-7-12-2-1-5-25-12)13-8-18-9-20-17(13)24-11-3-4-14-15(6-11)23-10-22-14/h1-6,8-9H,7,10H2,(H,19,21)