2-[[2-(1-adamantyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-azanyl-quinazolin-4-one

Systemtic Name: 2-[[2-(1-adamantyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-azanyl-quinazolin-4-one Openeye Name: 2-[[2-(1-adamantyl)thiazol-4-yl]methylsulfanyl]-3-amino-quinazolin-4-one CAS Name: 2-[[2-(1-adamantyl)-4-thiazolyl]methylthio]-3-amino-4-quinazolinone IUPAC Name: 2-[[2-(1-adamantyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-aminoquinazolin-4-one Traditional Name: 2-[[2-(1-adamantyl)thiazol-4-yl]methylthio]-3-amino-quinazolin-4-one Formula: C22H24N4OS2 MolecularWeight: 424.58216

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NC(=CS4)CSC5=NC6=CC=CC=C6C(=O)N5N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NC(=CS4)CSC5=NC6=CC=CC=C6C(=O)N5N

InChI

InChI=1S/C22H24N4OS2/c23-26-19(27)17-3-1-2-4-18(17)25-21(26)29-12-16-11-28-20(24-16)22-8-13-5-14(9-22)7-15(6-13)10-22/h1-4,11,13-15H,5-10,12,23H2