N-(3,5-dimethylphenyl)-2-methylsulfonyl-3-[2-(propan-2-ylamino)ethoxy]benzamide hydrochloride

Systemtic Name: N-(3,5-dimethylphenyl)-2-methylsulfonyl-3-[2-(propan-2-ylamino)ethoxy]benzamide hydrochloride Openeye Name: N-(3,5-dimethylphenyl)-3-[2-(isopropylamino)ethoxy]-2-methylsulfonyl-benzamide hydrochloride CAS Name: N-(3,5-dimethylphenyl)-2-methylsulfonyl-3-[2-(propan-2-ylamino)ethoxy]benzamide hydrochloride IUPAC Name: N-(3,5-dimethylphenyl)-2-methylsulfonyl-3-[2-(propan-2-ylamino)ethoxy]benzamide hydrochloride Traditional Name: N-(3,5-dimethylphenyl)-3-[2-(isopropylamino)ethoxy]-2-mesyl-benzamide hydrochloride Formula: C21H29ClN2O4S MolecularWeight: 440.98396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2=C(C(=CC=C2)OCCNC(C)C)S(=O)(=O)C)C.Cl

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=C(C(=CC=C2)OCCNC(C)C)S(=O)(=O)C)C.Cl

InChI

InChI=1S/C21H28N2O4S.ClH/c1-14(2)22-9-10-27-19-8-6-7-18(20(19)28(5,25)26)21(24)23-17-12-15(3)11-16(4)13-17;/h6-8,11-14,22H,9-10H2,1-5H3,(H,23,24);1H