3-methyl-2-[2-[(6-methyl-4-phenyl-quinazolin-2-yl)amino]ethanoylamino]butanoic acid

Systemtic Name: 3-methyl-2-[2-[(6-methyl-4-phenyl-quinazolin-2-yl)amino]ethanoylamino]butanoic acid Openeye Name: 3-methyl-2-[[2-[(6-methyl-4-phenyl-quinazolin-2-yl)amino]acetyl]amino]butanoic acid CAS Name: 3-methyl-2-[[2-[(6-methyl-4-phenyl-2-quinazolinyl)amino]-1-oxoethyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[2-[(6-methyl-4-phenylquinazolin-2-yl)amino]acetyl]amino]butanoic acid Traditional Name: 3-methyl-2-[[2-[(6-methyl-4-phenyl-quinazolin-2-yl)amino]acetyl]amino]butyric acid Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)NCC(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)NCC(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C22H24N4O3/c1-13(2)19(21(28)29)25-18(27)12-23-22-24-17-10-9-14(3)11-16(17)20(26-22)15-7-5-4-6-8-15/h4-11,13,19H,12H2,1-3H3,(H,25,27)(H,28,29)(H,23,24,26)