3-(2,3-dimethylcyclohexyl)-2-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(2,3-dimethylcyclohexyl)-2-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(2,3-dimethylcyclohexyl)-2-[(2-ethylthiazol-4-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(2,3-dimethylcyclohexyl)-2-[(2-ethyl-4-thiazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-(2,3-dimethylcyclohexyl)-2-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(2,3-dimethylcyclohexyl)-2-[(2-ethylthiazol-4-yl)methylthio]quinazolin-4-one Formula: C22H27N3OS2 MolecularWeight: 413.59928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC(C4C)C

Isomeric SMILES

CCC1=NC(=CS1)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC(C4C)C

InChI

InChI=1S/C22H27N3OS2/c1-4-20-23-16(12-27-20)13-28-22-24-18-10-6-5-9-17(18)21(26)25(22)19-11-7-8-14(2)15(19)3/h5-6,9-10,12,14-15,19H,4,7-8,11,13H2,1-3H3