N-[[(2R)-butan-2-yl]carbamoyl]-2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[[(2R)-butan-2-yl]carbamoyl]-2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-[[(1R)-1-methylpropyl]carbamoyl]-2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-[[[(2R)-butan-2-yl]amino]-oxomethyl]-2-[4-(4-propylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[[(2R)-butan-2-yl]carbamoyl]-2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-[[(1R)-1-methylpropyl]carbamoyl]-2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C20H33N4O4S+ MolecularWeight: 425.56542

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC(=O)NC(C)CC

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC(=O)N[C@H](C)CC

InChI

InChI=1S/C20H32N4O4S/c1-4-6-17-7-9-18(10-8-17)29(27,28)24-13-11-23(12-14-24)15-19(25)22-20(26)21-16(3)5-2/h7-10,16H,4-6,11-15H2,1-3H3,(H2,21,22,25,26)/p+1/t16-/m1/s1