(2R)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: (2R)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Openeye Name: (2R)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide CAS Name: (2R)-2-[[4-(ethylamino)-2-quinazolinyl]thio]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: (2R)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Traditional Name: (2R)-2-[[4-(ethylamino)quinazolin-2-yl]thio]-N-(4-sulfamoylphenyl)propionamide Formula: C19H21N5O3S2 MolecularWeight: 431.53174

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)S[C@H](C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C19H21N5O3S2/c1-3-21-17-15-6-4-5-7-16(15)23-19(24-17)28-12(2)18(25)22-13-8-10-14(11-9-13)29(20,26)27/h4-12H,3H2,1-2H3,(H,22,25)(H2,20,26,27)(H,21,23,24)/t12-/m1/s1