N-[(5R)-5-(4-ethylpiperazin-4-ium-1-yl)carbonyl-7-oxidanylidene-5,6-dihydro-4H-1,3-benzothiazol-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(5R)-5-(4-ethylpiperazin-4-ium-1-yl)carbonyl-7-oxidanylidene-5,6-dihydro-4H-1,3-benzothiazol-2-yl]thiophene-2-carboxamide Openeye Name: N-[(5R)-5-(4-ethylpiperazin-4-ium-1-carbonyl)-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]thiophene-2-carboxamide CAS Name: N-[(5R)-5-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(5R)-5-(4-ethylpiperazin-4-ium-1-carbonyl)-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]thiophene-2-carboxamide Traditional Name: N-[(5R)-5-(4-ethylpiperazin-4-ium-1-carbonyl)-7-keto-5,6-dihydro-4H-1,3-benzothiazol-2-yl]thiophene-2-carboxamide Formula: C19H23N4O3S2+ MolecularWeight: 419.54092

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2CC3=C(C(=O)C2)SC(=N3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)[C@@H]2CC3=C(C(=O)C2)SC(=N3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C19H22N4O3S2/c1-2-22-5-7-23(8-6-22)18(26)12-10-13-16(14(24)11-12)28-19(20-13)21-17(25)15-4-3-9-27-15/h3-4,9,12H,2,5-8,10-11H2,1H3,(H,20,21,25)/p+1/t12-/m1/s1