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

Systemtic Name: 2-[[4-azanyl-6-[(2-ethylphenyl)amino]-1,3,5-triazin-2-yl]methylsulfanyl]-3-propan-2-yl-quinazolin-4-one Openeye Name: 2-[[4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methylsulfanyl]-3-isopropyl-quinazolin-4-one CAS Name: 2-[[4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methylthio]-3-propan-2-yl-4-quinazolinone IUPAC Name: 2-[[4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methylsulfanyl]-3-propan-2-ylquinazolin-4-one Traditional Name: 2-[[4-amino-6-(2-ethylanilino)-s-triazin-2-yl]methylthio]-3-isopropyl-quinazolin-4-one Formula: C23H25N7OS MolecularWeight: 447.5559

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NC4=CC=CC=C4C(=O)N3C(C)C

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NC4=CC=CC=C4C(=O)N3C(C)C

InChI

InChI=1S/C23H25N7OS/c1-4-15-9-5-7-11-17(15)25-22-28-19(27-21(24)29-22)13-32-23-26-18-12-8-6-10-16(18)20(31)30(23)14(2)3/h5-12,14H,4,13H2,1-3H3,(H3,24,25,27,28,29)