N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-4-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)butanamide

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-4-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)butanamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-4-(4-methyl-2-oxo-thiazol-3-yl)butanamide CAS Name: N-[4-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-4-(4-methyl-2-oxo-3-thiazolyl)butanamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]-4-(2-keto-4-methyl-4-thiazolin-3-yl)butyramide Formula: C20H29N4O4S2+ MolecularWeight: 453.59866

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCN3C(=CSC3=O)C

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCN3C(=CSC3=O)C

InChI

InChI=1S/C20H28N4O4S2/c1-3-22-11-13-23(14-12-22)30(27,28)18-8-6-17(7-9-18)21-19(25)5-4-10-24-16(2)15-29-20(24)26/h6-9,15H,3-5,10-14H2,1-2H3,(H,21,25)/p+1