2-(3-methylbutylsulfanyl)-4a,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one

Systemtic Name: 2-(3-methylbutylsulfanyl)-4a,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one Openeye Name: 2-isopentylsulfanyl-4a,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one CAS Name: 2-(3-methylbutylthio)-4a,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one IUPAC Name: 2-(3-methylbutylsulfanyl)-4a,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one Traditional Name: 2-(isoamylthio)-4a,5,6,7-tetrahydrocyclopenta[d]pyrimidin-4-one Formula: C12H18N2OS MolecularWeight: 238.34912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NC(=O)C2CCCC2=N1

Isomeric SMILES

CC(C)CCSC1=NC(=O)C2CCCC2=N1

InChI

InChI=1S/C12H18N2OS/c1-8(2)6-7-16-12-13-10-5-3-4-9(10)11(15)14-12/h8-9H,3-7H2,1-2H3