4-[4-(phenylmethyl)piperazin-1-yl]-2-pyrrolidin-1-yl-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidine

Systemtic Name: 4-[4-(phenylmethyl)piperazin-1-yl]-2-pyrrolidin-1-yl-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidine Openeye Name: 4-(4-benzylpiperazin-1-yl)-2-pyrrolidin-1-yl-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidine CAS Name: 4-[4-(phenylmethyl)-1-piperazinyl]-2-(1-pyrrolidinyl)-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidine IUPAC Name: 4-(4-benzylpiperazin-1-yl)-2-pyrrolidin-1-yl-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidine Traditional Name: 4-(4-benzylpiperazino)-2-pyrrolidino-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidine Formula: C22H29N5S MolecularWeight: 395.56416

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=C(C(=N2)N4CCN(CC4)CC5=CC=CC=C5)SCCC3

Isomeric SMILES

C1CCN(C1)C2=NC3=C(C(=N2)N4CCN(CC4)CC5=CC=CC=C5)SCCC3

InChI

InChI=1S/C22H29N5S/c1-2-7-18(8-3-1)17-25-12-14-26(15-13-25)21-20-19(9-6-16-28-20)23-22(24-21)27-10-4-5-11-27/h1-3,7-8H,4-6,9-17H2