1-[(5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-6-yl)carbonyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[(5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-6-yl)carbonyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carbonyl)-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[(5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-6-yl)-oxomethyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carbonyl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carbonyl)-N-(3-pyridylmethyl)isonipecotamide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC=N2)C(=O)N3CCC(CC3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC=N2)C(=O)N3CCC(CC3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C20H21N5O3S/c1-12-15-18(27)23-11-24-19(15)29-16(12)20(28)25-7-4-14(5-8-25)17(26)22-10-13-3-2-6-21-9-13/h2-3,6,9,11,14H,4-5,7-8,10H2,1H3,(H,22,26)(H,23,24,27)