1-[2-[3-methyl-4-(5-methylhexoxy)phenyl]ethyl]-2-sulfanylidene-1,3-diazinan-4-one

Systemtic Name: 1-[2-[3-methyl-4-(5-methylhexoxy)phenyl]ethyl]-2-sulfanylidene-1,3-diazinan-4-one Openeye Name: 1-[2-[3-methyl-4-(5-methylhexoxy)phenyl]ethyl]-2-thioxo-hexahydropyrimidin-4-one CAS Name: 1-[2-[3-methyl-4-(5-methylhexoxy)phenyl]ethyl]-2-sulfanylidene-1,3-diazinan-4-one IUPAC Name: 1-[2-[3-methyl-4-(5-methylhexoxy)phenyl]ethyl]-2-sulfanylidene-1,3-diazinan-4-one Traditional Name: 1-[2-[3-methyl-4-(5-methylhexoxy)phenyl]ethyl]-2-thioxo-hexahydropyrimidin-4-one Formula: C20H30N2O2S MolecularWeight: 362.5294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCN2CCC(=O)NC2=S)OCCCCC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)CCN2CCC(=O)NC2=S)OCCCCC(C)C

InChI

InChI=1S/C20H30N2O2S/c1-15(2)6-4-5-13-24-18-8-7-17(14-16(18)3)9-11-22-12-10-19(23)21-20(22)25/h7-8,14-15H,4-6,9-13H2,1-3H3,(H,21,23,25)