4-[(3-ethanoylphenyl)amino]-N-(1-methylpiperidin-4-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-[(3-ethanoylphenyl)amino]-N-(1-methylpiperidin-4-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(3-acetylanilino)-N-(1-methyl-4-piperidyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-(3-acetylanilino)-N-(1-methyl-4-piperidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-(3-acetylanilino)-N-(1-methylpiperidin-4-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(3-acetylanilino)-N-(1-methyl-4-piperidyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC2=C3C=C(SC3=NC=N2)C(=O)NC4CCN(CC4)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC2=C3C=C(SC3=NC=N2)C(=O)NC4CCN(CC4)C

InChI

InChI=1S/C21H23N5O2S/c1-13(27)14-4-3-5-16(10-14)24-19-17-11-18(29-21(17)23-12-22-19)20(28)25-15-6-8-26(2)9-7-15/h3-5,10-12,15H,6-9H2,1-2H3,(H,25,28)(H,22,23,24)