methyl 4-[2-[butyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[butyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[butyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetyl]amino]benzoate CAS Name: 4-[[2-[butyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[butyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetyl]amino]benzoate Traditional Name: 4-[[2-[butyl-[(4-keto-1H-quinazolin-2-yl)methyl]amino]acetyl]amino]benzoic acid methyl ester Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H26N4O4/c1-3-4-13-27(14-20-25-19-8-6-5-7-18(19)22(29)26-20)15-21(28)24-17-11-9-16(10-12-17)23(30)31-2/h5-12H,3-4,13-15H2,1-2H3,(H,24,28)(H,25,26,29)