(2S)-2-azanyl-3-phenyl-N-[4-[2-[(4-sulfamoylphenyl)amino]pyrimidin-4-yl]phenyl]propanamide

Systemtic Name: (2S)-2-azanyl-3-phenyl-N-[4-[2-[(4-sulfamoylphenyl)amino]pyrimidin-4-yl]phenyl]propanamide Openeye Name: (2S)-2-amino-3-phenyl-N-[4-[2-(4-sulfamoylanilino)pyrimidin-4-yl]phenyl]propanamide CAS Name: (2S)-2-amino-3-phenyl-N-[4-[2-(4-sulfamoylanilino)-4-pyrimidinyl]phenyl]propanamide IUPAC Name: (2S)-2-amino-3-phenyl-N-[4-[2-(4-sulfamoylanilino)pyrimidin-4-yl]phenyl]propanamide Traditional Name: (2S)-2-amino-3-phenyl-N-[4-[2-(4-sulfamoylanilino)pyrimidin-4-yl]phenyl]propionamide Formula: C25H24N6O3S MolecularWeight: 488.56146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)S(=O)(=O)N)N

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NC2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)S(=O)(=O)N)N

InChI

InChI=1S/C25H24N6O3S/c26-22(16-17-4-2-1-3-5-17)24(32)29-19-8-6-18(7-9-19)23-14-15-28-25(31-23)30-20-10-12-21(13-11-20)35(27,33)34/h1-15,22H,16,26H2,(H,29,32)(H2,27,33,34)(H,28,30,31)/t22-/m0/s1