2-[(7-methyl-4-oxidanylidene-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]ethanamide

Systemtic Name: 2-[(7-methyl-4-oxidanylidene-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]ethanamide Openeye Name: 2-[(3-allyl-7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[5-(p-tolyl)-1,2,4-thiadiazol-3-yl]acetamide CAS Name: 2-[(7-methyl-4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide IUPAC Name: 2-[(7-methyl-4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[5-(4-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide Traditional Name: 2-[(3-allyl-4-keto-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)thio]-N-[5-(p-tolyl)-1,2,4-thiadiazol-3-yl]acetamide Formula: C25H25N5O2S3 MolecularWeight: 523.6933

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)NC4=NSC(=N4)C5=CC=C(C=C5)C)CC=C

Isomeric SMILES

CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)NC4=NSC(=N4)C5=CC=C(C=C5)C)CC=C

InChI

InChI=1S/C25H25N5O2S3/c1-4-11-30-23(32)20-17-10-7-15(3)12-18(17)34-22(20)28-25(30)33-13-19(31)26-24-27-21(35-29-24)16-8-5-14(2)6-9-16/h4-6,8-9,15H,1,7,10-13H2,2-3H3,(H,26,29,31)