N-cyclopropyl-2-[4-[2-[(4-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[2-[(4-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[2-(4-morpholinosulfonylanilino)-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[2-[4-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[2-(4-morpholin-4-ylsulfonylanilino)-2-oxoethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[2-keto-2-(4-morpholinosulfonylanilino)ethyl]piperazin-1-ium-1-yl]acetamide Formula: C21H32N5O5S+ MolecularWeight: 466.57428

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CCN(CC2)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CCN(CC2)CC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H31N5O5S/c27-20(22-17-1-2-17)15-24-7-9-25(10-8-24)16-21(28)23-18-3-5-19(6-4-18)32(29,30)26-11-13-31-14-12-26/h3-6,17H,1-2,7-16H2,(H,22,27)(H,23,28)/p+1