5-(3-methylbutyl)-5-[2-(oxan-2-yloxy)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-(3-methylbutyl)-5-[2-(oxan-2-yloxy)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-isopentyl-5-(2-tetrahydropyran-2-yloxyethyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-(3-methylbutyl)-5-[2-(2-oxanyloxy)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(3-methylbutyl)-5-[2-(oxan-2-yloxy)ethyl]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-isoamyl-5-(2-tetrahydropyran-2-yloxyethyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H26N2O4S MolecularWeight: 342.45364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(C(=O)NC(=S)NC1=O)CCOC2CCCCO2

Isomeric SMILES

CC(C)CCC1(C(=O)NC(=S)NC1=O)CCOC2CCCCO2

InChI

InChI=1S/C16H26N2O4S/c1-11(2)6-7-16(13(19)17-15(23)18-14(16)20)8-10-22-12-5-3-4-9-21-12/h11-12H,3-10H2,1-2H3,(H2,17,18,19,20,23)