butyl (2S)-2-[[4-[(2-azanyl-4-oxidanylidene-1H-quinazolin-6-yl)sulfonylamino]phenyl]carbonylamino]pentanoate

Systemtic Name: butyl (2S)-2-[[4-[(2-azanyl-4-oxidanylidene-1H-quinazolin-6-yl)sulfonylamino]phenyl]carbonylamino]pentanoate Openeye Name: butyl (2S)-2-[[4-[(2-amino-4-oxo-1H-quinazolin-6-yl)sulfonylamino]benzoyl]amino]pentanoate CAS Name: (2S)-2-[[[4-[(2-amino-4-oxo-1H-quinazolin-6-yl)sulfonylamino]phenyl]-oxomethyl]amino]pentanoic acid butyl ester IUPAC Name: butyl (2S)-2-[[4-[(2-amino-4-oxo-1H-quinazolin-6-yl)sulfonylamino]benzoyl]amino]pentanoate Traditional Name: (2S)-2-[[4-[(2-amino-4-keto-1H-quinazolin-6-yl)sulfonylamino]benzoyl]amino]valeric acid butyl ester Formula: C24H29N5O6S MolecularWeight: 515.58196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CCC)NC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(=NC3=O)N

Isomeric SMILES

CCCCOC(=O)[C@H](CCC)NC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(=NC3=O)N

InChI

InChI=1S/C24H29N5O6S/c1-3-5-13-35-23(32)20(6-4-2)26-21(30)15-7-9-16(10-8-15)29-36(33,34)17-11-12-19-18(14-17)22(31)28-24(25)27-19/h7-12,14,20,29H,3-6,13H2,1-2H3,(H,26,30)(H3,25,27,28,31)/t20-/m0/s1