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

Systemtic Name: 4-(1,3-benzodioxol-5-yloxy)-N-(1-thiophen-2-ylethyl)pyrimidine-5-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-yloxy)-N-[1-(2-thienyl)ethyl]pyrimidine-5-carboxamide CAS Name: 4-(1,3-benzodioxol-5-yloxy)-N-(1-thiophen-2-ylethyl)-5-pyrimidinecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-yloxy)-N-(1-thiophen-2-ylethyl)pyrimidine-5-carboxamide Traditional Name: 4-(1,3-benzodioxol-5-yloxy)-N-[1-(2-thienyl)ethyl]pyrimidine-5-carboxamide Formula: C18H15N3O4S MolecularWeight: 369.3944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)C2=CN=CN=C2OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C1=CC=CS1)NC(=O)C2=CN=CN=C2OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H15N3O4S/c1-11(16-3-2-6-26-16)21-17(22)13-8-19-9-20-18(13)25-12-4-5-14-15(7-12)24-10-23-14/h2-9,11H,10H2,1H3,(H,21,22)