N-[(2,3-dimethoxyphenyl)methyl]-5-methyl-4-(thiophen-2-ylmethylamino)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-5-methyl-4-(thiophen-2-ylmethylamino)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-5-methyl-4-(2-thienylmethylamino)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-5-methyl-4-(thiophen-2-ylmethylamino)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-5-methyl-4-(thiophen-2-ylmethylamino)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 5-methyl-N-o-veratryl-4-(2-thenylamino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H22N4O3S2 MolecularWeight: 454.56508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCC3=CC=CS3)C(=O)NCC4=C(C(=CC=C4)OC)OC

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCC3=CC=CS3)C(=O)NCC4=C(C(=CC=C4)OC)OC

InChI

InChI=1S/C22H22N4O3S2/c1-13-17-20(23-11-15-7-5-9-30-15)25-12-26-22(17)31-19(13)21(27)24-10-14-6-4-8-16(28-2)18(14)29-3/h4-9,12H,10-11H2,1-3H3,(H,24,27)(H,23,25,26)