5-ethyl-5-methyl-3-(phenylmethyl)-2-sulfanylidene-1,6-dihydrobenzo[h]quinazolin-4-one

Systemtic Name: 5-ethyl-5-methyl-3-(phenylmethyl)-2-sulfanylidene-1,6-dihydrobenzo[h]quinazolin-4-one Openeye Name: 3-benzyl-5-ethyl-5-methyl-2-thioxo-1,6-dihydrobenzo[h]quinazolin-4-one CAS Name: 5-ethyl-5-methyl-3-(phenylmethyl)-2-sulfanylidene-1,6-dihydrobenzo[h]quinazolin-4-one IUPAC Name: 3-benzyl-5-ethyl-5-methyl-2-sulfanylidene-1,6-dihydrobenzo[h]quinazolin-4-one Traditional Name: 3-benzyl-5-ethyl-5-methyl-2-thioxo-1,6-dihydrobenzo[h]quinazolin-4-one Formula: C22H22N2OS MolecularWeight: 362.48788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=S)N3)CC4=CC=CC=C4)C

Isomeric SMILES

CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=S)N3)CC4=CC=CC=C4)C

InChI

InChI=1S/C22H22N2OS/c1-3-22(2)13-16-11-7-8-12-17(16)19-18(22)20(25)24(21(26)23-19)14-15-9-5-4-6-10-15/h4-12H,3,13-14H2,1-2H3,(H,23,26)