4-[[(6S)-2-azanylidene-3-[(Z)-furan-2-ylmethylideneamino]-4-oxidanylidene-1,3-thiazinan-6-yl]carbonylamino]benzoate

Systemtic Name: 4-[[(6S)-2-azanylidene-3-[(Z)-furan-2-ylmethylideneamino]-4-oxidanylidene-1,3-thiazinan-6-yl]carbonylamino]benzoate Openeye Name: 4-[[(6S)-3-[(Z)-2-furylmethyleneamino]-2-imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoate CAS Name: 4-[[[(6S)-3-[(Z)-2-furanylmethylideneamino]-2-imino-4-oxo-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoate IUPAC Name: 4-[[(6S)-3-[(Z)-furan-2-ylmethylideneamino]-2-imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoate Traditional Name: 4-[[(6S)-3-[(Z)-2-furfurylideneamino]-2-imino-4-keto-1,3-thiazinane-6-carbonyl]amino]benzoate Formula: C17H13N4O5S- MolecularWeight: 385.37392

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC(=N)N(C1=O)N=CC2=CC=CO2)C(=O)NC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1[C@H](SC(=N)N(C1=O)/N=C\C2=CC=CO2)C(=O)NC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C17H14N4O5S/c18-17-21(19-9-12-2-1-7-26-12)14(22)8-13(27-17)15(23)20-11-5-3-10(4-6-11)16(24)25/h1-7,9,13,18H,8H2,(H,20,23)(H,24,25)/p-1/b18-17?,19-9-/t13-/m0/s1