3-[(1R,4R,5R)-5-bicyclo[2.2.1]hept-2-enyl]-6-methyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[(1R,4R,5R)-5-bicyclo[2.2.1]hept-2-enyl]-6-methyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[(1R,4R,5R)-5-bicyclo[2.2.1]hept-2-enyl]-6-methyl-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(1R,4R,5R)-5-bicyclo[2.2.1]hept-2-enyl]-6-methyl-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[(1R,4R,5R)-5-bicyclo[2.2.1]hept-2-enyl]-6-methyl-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[(1R,4R,5R)-5-bicyclo[2.2.1]hept-2-enyl]-6-methyl-2-thioxo-1H-quinazolin-4-one Formula: C16H16N2OS MolecularWeight: 284.37604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=S)N(C2=O)C3CC4CC3C=C4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=S)N(C2=O)[C@@H]3C[C@H]4C[C@@H]3C=C4

InChI

InChI=1S/C16H16N2OS/c1-9-2-5-13-12(6-9)15(19)18(16(20)17-13)14-8-10-3-4-11(14)7-10/h2-6,10-11,14H,7-8H2,1H3,(H,17,20)/t10-,11+,14-/m1/s1