N-(5-methyl-1,2-oxazol-3-yl)-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide hydrochloride

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide hydrochloride Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(5-methylisoxazol-3-yl)benzamide hydrochloride CAS Name: N-(5-methyl-3-isoxazolyl)-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide hydrochloride IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(5-methyl-1,2-oxazol-3-yl)benzamide hydrochloride Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-(5-methylisoxazol-3-yl)benzamide hydrochloride Formula: C22H25ClN4O4S MolecularWeight: 476.9763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4.Cl

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4.Cl

InChI

InChI=1S/C22H24N4O4S.ClH/c1-17-14-21(24-30-17)23-22(27)19-8-5-9-20(15-19)31(28,29)26-12-10-25(11-13-26)16-18-6-3-2-4-7-18;/h2-9,14-15H,10-13,16H2,1H3,(H,23,24,27);1H