2-butylsulfanyl-6-methyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-butylsulfanyl-6-methyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-butylsulfanyl-6-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-(butylthio)-6-methyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-butylsulfanyl-6-methyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-(butylthio)-6-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C18H24N2OS2 MolecularWeight: 348.52596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(C3=C(S2)CCC(C3)C)C(=O)N1CC=C

Isomeric SMILES

CCCCSC1=NC2=C(C3=C(S2)CCC(C3)C)C(=O)N1CC=C

InChI

InChI=1S/C18H24N2OS2/c1-4-6-10-22-18-19-16-15(17(21)20(18)9-5-2)13-11-12(3)7-8-14(13)23-16/h5,12H,2,4,6-11H2,1,3H3