4-[4-(1,4-dithiepan-6-yl)piperazin-1-yl]-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine

Systemtic Name: 4-[4-(1,4-dithiepan-6-yl)piperazin-1-yl]-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine Openeye Name: 4-[4-(1,4-dithiepan-6-yl)piperazin-1-yl]-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine CAS Name: 4-[4-(1,4-dithiepan-6-yl)-1-piperazinyl]-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine IUPAC Name: 4-[4-(1,4-dithiepan-6-yl)piperazin-1-yl]-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine Traditional Name: 4-[4-(1,4-dithiepan-6-yl)piperazino]-2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine Formula: C22H28N4S2 MolecularWeight: 412.61452

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N=C(N=C2N3CCN(CC3)C4CSCCSC4)C5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C1)N=C(N=C2N3CCN(CC3)C4CSCCSC4)C5=CC=CC=C5

InChI

InChI=1S/C22H28N4S2/c1-2-5-17(6-3-1)21-23-20-8-4-7-19(20)22(24-21)26-11-9-25(10-12-26)18-15-27-13-14-28-16-18/h1-3,5-6,18H,4,7-16H2