N-butyl-2-(3-chlorophenyl)-5-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-butyl-2-(3-chlorophenyl)-5-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-butyl-2-(3-chlorophenyl)-5-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]triazole-4-carboxamide CAS Name: N-butyl-2-(3-chlorophenyl)-5-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-4-triazolecarboxamide IUPAC Name: N-butyl-2-(3-chlorophenyl)-5-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]triazole-4-carboxamide Traditional Name: N-butyl-2-(3-chlorophenyl)-N-[(4-keto-1H-quinazolin-2-yl)methyl]-5-methyl-triazole-4-carboxamide Formula: C23H23ClN6O2 MolecularWeight: 450.92072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=NN(N=C3C)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=NN(N=C3C)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H23ClN6O2/c1-3-4-12-29(14-20-25-19-11-6-5-10-18(19)22(31)26-20)23(32)21-15(2)27-30(28-21)17-9-7-8-16(24)13-17/h5-11,13H,3-4,12,14H2,1-2H3,(H,25,26,31)