9-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butylamino]-8-thia-10-azaspiro[4.5]dec-9-en-7-one

Systemtic Name: 9-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butylamino]-8-thia-10-azaspiro[4.5]dec-9-en-7-one Openeye Name: 9-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butylamino]-8-thia-10-azaspiro[4.5]dec-9-en-7-one CAS Name: 9-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butylamino]-8-thia-10-azaspiro[4.5]dec-9-en-7-one IUPAC Name: 9-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butylamino]-8-thia-10-azaspiro[4.5]dec-9-en-7-one Traditional Name: 9-[4-[4-(2-pyrimidyl)piperazino]butylamino]-8-thia-10-azaspiro[4.5]dec-9-en-7-one Formula: C20H30N6OS MolecularWeight: 402.5568

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)CC(=O)SC(=N2)NCCCCN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CCC2(C1)CC(=O)SC(=N2)NCCCCN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H30N6OS/c27-17-16-20(6-1-2-7-20)24-19(28-17)23-8-3-4-11-25-12-14-26(15-13-25)18-21-9-5-10-22-18/h5,9-10H,1-4,6-8,11-16H2,(H,23,24)