7-methyl-2-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 7-methyl-2-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[1-(3-isopropyl-1,2,4-oxadiazol-5-yl)ethylsulfanyl]-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 7-methyl-2-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethylthio]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 7-methyl-2-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[1-(3-isopropyl-1,2,4-oxadiazol-5-yl)ethylthio]-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C21H26N4O2S2 MolecularWeight: 430.58674

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SC(C)C4=NC(=NO4)C(C)C)CC=C

Isomeric SMILES

CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SC(C)C4=NC(=NO4)C(C)C)CC=C

InChI

InChI=1S/C21H26N4O2S2/c1-6-9-25-20(26)16-14-8-7-12(4)10-15(14)29-19(16)23-21(25)28-13(5)18-22-17(11(2)3)24-27-18/h6,11-13H,1,7-10H2,2-5H3