methyl (2S)-2-[[2-[(cyclopropylcarbonylamino)methyl]quinazolin-4-yl]amino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[[2-[(cyclopropylcarbonylamino)methyl]quinazolin-4-yl]amino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[[2-[(cyclopropanecarbonylamino)methyl]quinazolin-4-yl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[2-[[[cyclopropyl(oxo)methyl]amino]methyl]-4-quinazolinyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-[(cyclopropanecarbonylamino)methyl]quinazolin-4-yl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[2-[(cyclopropanecarbonylamino)methyl]quinazolin-4-yl]amino]-3-methyl-butyric acid methyl ester Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC1=NC(=NC2=CC=CC=C21)CNC(=O)C3CC3

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC1=NC(=NC2=CC=CC=C21)CNC(=O)C3CC3

InChI

InChI=1S/C19H24N4O3/c1-11(2)16(19(25)26-3)23-17-13-6-4-5-7-14(13)21-15(22-17)10-20-18(24)12-8-9-12/h4-7,11-12,16H,8-10H2,1-3H3,(H,20,24)(H,21,22,23)/t16-/m0/s1