4-ethylsulfonyl-2-[(6-phenylpyrimidin-4-yl)amino]phenol hydrochloride

Systemtic Name: 4-ethylsulfonyl-2-[(6-phenylpyrimidin-4-yl)amino]phenol hydrochloride Openeye Name: 4-ethylsulfonyl-2-[(6-phenylpyrimidin-4-yl)amino]phenol hydrochloride CAS Name: 4-ethylsulfonyl-2-[(6-phenyl-4-pyrimidinyl)amino]phenol hydrochloride IUPAC Name: 4-ethylsulfonyl-2-[(6-phenylpyrimidin-4-yl)amino]phenol hydrochloride Traditional Name: 4-esyl-2-[(6-phenylpyrimidin-4-yl)amino]phenol hydrochloride Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC2=NC=NC(=C2)C3=CC=CC=C3.Cl

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC2=NC=NC(=C2)C3=CC=CC=C3.Cl

InChI

InChI=1S/C18H17N3O3S.ClH/c1-2-25(23,24)14-8-9-17(22)16(10-14)21-18-11-15(19-12-20-18)13-6-4-3-5-7-13;/h3-12,22H,2H2,1H3,(H,19,20,21);1H