2-[4-[1-(thian-4-yl)pyrrolidin-3-yl]piperidin-1-yl]pyrimidine

Systemtic Name: 2-[4-[1-(thian-4-yl)pyrrolidin-3-yl]piperidin-1-yl]pyrimidine Openeye Name: 2-[4-(1-tetrahydrothiopyran-4-ylpyrrolidin-3-yl)-1-piperidyl]pyrimidine CAS Name: 2-[4-[1-(4-thianyl)-3-pyrrolidinyl]-1-piperidinyl]pyrimidine IUPAC Name: 2-[4-[1-(thian-4-yl)pyrrolidin-3-yl]piperidin-1-yl]pyrimidine Traditional Name: 2-[4-(1-tetrahydrothiopyran-4-ylpyrrolidin-3-yl)piperidino]pyrimidine Formula: C18H28N4S MolecularWeight: 332.50672

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2CCN(C2)C3CCSCC3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1C2CCN(C2)C3CCSCC3)C4=NC=CC=N4

InChI

InChI=1S/C18H28N4S/c1-7-19-18(20-8-1)21-9-2-15(3-10-21)16-4-11-22(14-16)17-5-12-23-13-6-17/h1,7-8,15-17H,2-6,9-14H2