2-[[4-azanyl-5-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[[4-azanyl-5-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-ethanamide Openeye Name: 2-[[4-amino-5-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-acetamide CAS Name: 2-[[4-amino-5-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylthio]-1,2,4-triazol-3-yl]thio]-N,N-diethylacetamide IUPAC Name: 2-[[4-amino-5-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethylacetamide Traditional Name: 2-[[4-amino-5-[(4-keto-8-methyl-1H-quinazolin-2-yl)methylthio]-1,2,4-triazol-3-yl]thio]-N,N-diethyl-acetamide Formula: C18H23N7O2S2 MolecularWeight: 433.55092

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NN=C(N1N)SCC2=NC(=O)C3=C(N2)C(=CC=C3)C

Isomeric SMILES

CCN(CC)C(=O)CSC1=NN=C(N1N)SCC2=NC(=O)C3=C(N2)C(=CC=C3)C

InChI

InChI=1S/C18H23N7O2S2/c1-4-24(5-2)14(26)10-29-18-23-22-17(25(18)19)28-9-13-20-15-11(3)7-6-8-12(15)16(27)21-13/h6-8H,4-5,9-10,19H2,1-3H3,(H,20,21,27)