dimethyl-[(1S)-2-[[(2R)-2-methyl-3-oxidanylidene-4H-1,4-benzothiazin-6-yl]carbonylamino]-1-thiophen-2-yl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[[(2R)-2-methyl-3-oxidanylidene-4H-1,4-benzothiazin-6-yl]carbonylamino]-1-thiophen-2-yl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[[(2R)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]-1-(2-thienyl)ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[[(2R)-2-methyl-3-oxo-4H-1,4-benzothiazin-6-yl]-oxomethyl]amino]-1-thiophen-2-ylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[[(2R)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]-1-thiophen-2-ylethyl]azanium Traditional Name: [(1S)-2-[[(2R)-3-keto-2-methyl-4H-1,4-benzothiazine-6-carbonyl]amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C18H22N3O2S2+ MolecularWeight: 376.51618

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NCC(C3=CC=CS3)[NH+](C)C

Isomeric SMILES

C[C@@H]1C(=O)NC2=C(S1)C=CC(=C2)C(=O)NC[C@@H](C3=CC=CS3)[NH+](C)C

InChI

InChI=1S/C18H21N3O2S2/c1-11-17(22)20-13-9-12(6-7-15(13)25-11)18(23)19-10-14(21(2)3)16-5-4-8-24-16/h4-9,11,14H,10H2,1-3H3,(H,19,23)(H,20,22)/p+1/t11-,14+/m1/s1