4-(1,3-benzodioxol-5-yloxy)-N-[(4-chloranylthiophen-2-yl)methyl]pyrimidine-5-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-yloxy)-N-[(4-chloranylthiophen-2-yl)methyl]pyrimidine-5-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-yloxy)-N-[(4-chloro-2-thienyl)methyl]pyrimidine-5-carboxamide CAS Name: 4-(1,3-benzodioxol-5-yloxy)-N-[(4-chloro-2-thiophenyl)methyl]-5-pyrimidinecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-yloxy)-N-[(4-chlorothiophen-2-yl)methyl]pyrimidine-5-carboxamide Traditional Name: 4-(1,3-benzodioxol-5-yloxy)-N-[(4-chloro-2-thienyl)methyl]pyrimidine-5-carboxamide Formula: C17H12ClN3O4S MolecularWeight: 389.81288

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C17H12ClN3O4S/c18-10-3-12(26-7-10)5-20-16(22)13-6-19-8-21-17(13)25-11-1-2-14-15(4-11)24-9-23-14/h1-4,6-8H,5,9H2,(H,20,22)