4-[1-[4-oxidanylidene-3-(phenylmethyl)thieno[2,3-d]pyrimidin-2-yl]propyl]piperazine-1-carboxamide

Systemtic Name: 4-[1-[4-oxidanylidene-3-(phenylmethyl)thieno[2,3-d]pyrimidin-2-yl]propyl]piperazine-1-carboxamide Openeye Name: 4-[1-(3-benzyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)propyl]piperazine-1-carboxamide CAS Name: 4-[1-[4-oxo-3-(phenylmethyl)-2-thieno[2,3-d]pyrimidinyl]propyl]-1-piperazinecarboxamide IUPAC Name: 4-[1-(3-benzyl-4-oxothieno[2,3-d]pyrimidin-2-yl)propyl]piperazine-1-carboxamide Traditional Name: 4-[1-(3-benzyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)propyl]piperazine-1-carboxamide Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C=CS2)C(=O)N1CC3=CC=CC=C3)N4CCN(CC4)C(=O)N

Isomeric SMILES

CCC(C1=NC2=C(C=CS2)C(=O)N1CC3=CC=CC=C3)N4CCN(CC4)C(=O)N

InChI

InChI=1S/C21H25N5O2S/c1-2-17(24-9-11-25(12-10-24)21(22)28)18-23-19-16(8-13-29-19)20(27)26(18)14-15-6-4-3-5-7-15/h3-8,13,17H,2,9-12,14H2,1H3,(H2,22,28)