N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)-N-[4-(4-methylpiperidino)sulfonylphenyl]propionamide Formula: C21H24N4O4S2 MolecularWeight: 460.56966

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCN3C=NC4=C(C3=O)C=CS4

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCN3C=NC4=C(C3=O)C=CS4

InChI

InChI=1S/C21H24N4O4S2/c1-15-6-11-25(12-7-15)31(28,29)17-4-2-16(3-5-17)23-19(26)8-10-24-14-22-20-18(21(24)27)9-13-30-20/h2-5,9,13-15H,6-8,10-12H2,1H3,(H,23,26)