N-(2-methoxyphenyl)-5-methyl-4-(4-propylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(2-methoxyphenyl)-5-methyl-4-(4-propylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(2-methoxyphenyl)-5-methyl-4-(4-propylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(2-methoxyphenyl)-5-methyl-4-(4-propyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(2-methoxyphenyl)-5-methyl-4-(4-propylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(2-methoxyphenyl)-5-methyl-4-(4-propylpiperazino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C2=C3C(=C(SC3=NC=N2)C(=O)NC4=CC=CC=C4OC)C

Isomeric SMILES

CCCN1CCN(CC1)C2=C3C(=C(SC3=NC=N2)C(=O)NC4=CC=CC=C4OC)C

InChI

InChI=1S/C22H27N5O2S/c1-4-9-26-10-12-27(13-11-26)20-18-15(2)19(30-22(18)24-14-23-20)21(28)25-16-7-5-6-8-17(16)29-3/h5-8,14H,4,9-13H2,1-3H3,(H,25,28)