7-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-5,6-dihydro-4H-thieno[2,3-c]azepin-8-one

Systemtic Name: 7-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-5,6-dihydro-4H-thieno[2,3-c]azepin-8-one Openeye Name: 7-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-5,6-dihydro-4H-thieno[2,3-c]azepin-8-one CAS Name: 7-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-5,6-dihydro-4H-thieno[2,3-c]azepin-8-one IUPAC Name: 7-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-5,6-dihydro-4H-thieno[2,3-c]azepin-8-one Traditional Name: 7-[4-[4-(2-pyrimidyl)piperazino]butyl]-5,6-dihydro-4H-thien[2,3-c]azepin-8-one Formula: C20H27N5OS MolecularWeight: 385.52628

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)N(C1)CCCCN3CCN(CC3)C4=NC=CC=N4)SC=C2

Isomeric SMILES

C1CC2=C(C(=O)N(C1)CCCCN3CCN(CC3)C4=NC=CC=N4)SC=C2

InChI

InChI=1S/C20H27N5OS/c26-19-18-17(6-16-27-18)5-3-11-24(19)10-2-1-9-23-12-14-25(15-13-23)20-21-7-4-8-22-20/h4,6-8,16H,1-3,5,9-15H2