N-[(4-chlorophenyl)methyl]-5-methyl-4-oxidanylidene-2-(piperidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-5-methyl-4-oxidanylidene-2-(piperidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-5-methyl-4-oxo-2-(1-piperidylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-5-methyl-4-oxo-2-(1-piperidinylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-5-methyl-4-oxo-2-(piperidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(4-chlorobenzyl)-4-keto-5-methyl-2-(piperidinomethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H23ClN4O2S MolecularWeight: 430.95092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN3CCCCC3)C(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN3CCCCC3)C(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN4O2S/c1-13-17-19(27)24-16(12-26-9-3-2-4-10-26)25-21(17)29-18(13)20(28)23-11-14-5-7-15(22)8-6-14/h5-8H,2-4,9-12H2,1H3,(H,23,28)(H,24,25,27)