(4aS,8S,8aR)-1,3,4a-trimethyl-8-phenyl-8a-sulfanyl-2-sulfanylidene-5,6,7,8-tetrahydroquinazolin-4-one

Systemtic Name: (4aS,8S,8aR)-1,3,4a-trimethyl-8-phenyl-8a-sulfanyl-2-sulfanylidene-5,6,7,8-tetrahydroquinazolin-4-one Openeye Name: (4aS,8S,8aR)-1,3,4a-trimethyl-8-phenyl-8a-sulfanyl-2-thioxo-5,6,7,8-tetrahydroquinazolin-4-one CAS Name: (4aS,8S,8aR)-8a-mercapto-1,3,4a-trimethyl-8-phenyl-2-sulfanylidene-5,6,7,8-tetrahydroquinazolin-4-one IUPAC Name: (4aS,8S,8aR)-1,3,4a-trimethyl-8-phenyl-8a-sulfanyl-2-sulfanylidene-5,6,7,8-tetrahydroquinazolin-4-one Traditional Name: (4aS,8S,8aR)-8a-mercapto-1,3,4a-trimethyl-8-phenyl-2-thioxo-5,6,7,8-tetrahydroquinazolin-4-one Formula: C17H22N2OS2 MolecularWeight: 334.49938

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCCC(C1(N(C(=S)N(C2=O)C)C)S)C3=CC=CC=C3

Isomeric SMILES

C[C@@]12CCC[C@H]([C@@]1(N(C(=S)N(C2=O)C)C)S)C3=CC=CC=C3

InChI

InChI=1S/C17H22N2OS2/c1-16-11-7-10-13(12-8-5-4-6-9-12)17(16,22)19(3)15(21)18(2)14(16)20/h4-6,8-9,13,22H,7,10-11H2,1-3H3/t13-,16-,17+/m0/s1