N6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N4-(thiophen-2-ylmethyl)pyrimidine-4,6-dicarboxamide

Systemtic Name: N6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N4-(thiophen-2-ylmethyl)pyrimidine-4,6-dicarboxamide Openeye Name: N6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N4-(2-thienylmethyl)pyrimidine-4,6-dicarboxamide CAS Name: N6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N4-(thiophen-2-ylmethyl)pyrimidine-4,6-dicarboxamide IUPAC Name: 6-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-N-(thiophen-2-ylmethyl)pyrimidine-4,6-dicarboxamide Traditional Name: N'-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-(2-thenyl)pyrimidine-4,6-dicarboxamide Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CNC(=O)C3=CC(=NC=N3)C(=O)NCC4=CC=CS4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CNC(=O)C3=CC(=NC=N3)C(=O)NCC4=CC=CS4

InChI

InChI=1S/C20H18N4O4S/c25-19(21-10-13-3-4-17-18(8-13)28-6-5-27-17)15-9-16(24-12-23-15)20(26)22-11-14-2-1-7-29-14/h1-4,7-9,12H,5-6,10-11H2,(H,21,25)(H,22,26)