N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,5-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,5-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,5-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,5-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2,5-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-keto-2,5-dimethyl-3H-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C)C(=O)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)C)C(=O)NCC3COC4=CC=CC=C4O3

InChI

InChI=1S/C18H17N3O4S/c1-9-14-16(22)20-10(2)21-18(14)26-15(9)17(23)19-7-11-8-24-12-5-3-4-6-13(12)25-11/h3-6,11H,7-8H2,1-2H3,(H,19,23)(H,20,21,22)