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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)CCCN(C2=O)CCCN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=CC2=C(S1)CCCN(C2=O)CCCN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H27N5OS/c1-16-15-17-18(27-16)5-2-9-24(19(17)26)10-4-8-23-11-13-25(14-12-23)20-21-6-3-7-22-20/h3,6-7,15H,2,4-5,8-14H2,1H3