2-[[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanyl]-3-(4-ethylphenyl)quinazolin-4-one

Systemtic Name: 2-[[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanyl]-3-(4-ethylphenyl)quinazolin-4-one Openeye Name: 2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanyl]-3-(4-ethylphenyl)quinazolin-4-one CAS Name: 2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylthio]-3-(4-ethylphenyl)-4-quinazolinone IUPAC Name: 2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanyl]-3-(4-ethylphenyl)quinazolin-4-one Traditional Name: 2-[[4-amino-6-(dimethylamino)-s-triazin-2-yl]methylthio]-3-(4-ethylphenyl)quinazolin-4-one Formula: C22H23N7OS MolecularWeight: 433.52932

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC(=NC(=N4)N(C)C)N

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC(=NC(=N4)N(C)C)N

InChI

InChI=1S/C22H23N7OS/c1-4-14-9-11-15(12-10-14)29-19(30)16-7-5-6-8-17(16)24-22(29)31-13-18-25-20(23)27-21(26-18)28(2)3/h5-12H,4,13H2,1-3H3,(H2,23,25,26,27)