2-[[[4-(3,5-dimethylpyridin-1-ium-1-yl)-2-oxidanylidene-1,3-thiazol-5-ylidene]methylamino]carbamoyl]phenolate

Systemtic Name: 2-[[[4-(3,5-dimethylpyridin-1-ium-1-yl)-2-oxidanylidene-1,3-thiazol-5-ylidene]methylamino]carbamoyl]phenolate Openeye Name: 2-[[[4-(3,5-dimethylpyridin-1-ium-1-yl)-2-oxo-thiazol-5-ylidene]methylamino]carbamoyl]phenolate CAS Name: 2-[[[4-(3,5-dimethyl-1-pyridin-1-iumyl)-2-oxo-5-thiazolylidene]methylhydrazo]-oxomethyl]phenolate IUPAC Name: 2-[[[4-(3,5-dimethylpyridin-1-ium-1-yl)-2-oxo-1,3-thiazol-5-ylidene]methylamino]carbamoyl]phenolate Traditional Name: 2-[[[4-(3,5-dimethylpyridin-1-ium-1-yl)-2-keto-3-thiazolin-5-ylidene]methylamino]carbamoyl]phenolate Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C[N+](=C1)C2=NC(=O)SC2=CNNC(=O)C3=CC=CC=C3[O-])C

Isomeric SMILES

CC1=CC(=C[N+](=C1)C2=NC(=O)SC2=CNNC(=O)C3=CC=CC=C3[O-])C

InChI

InChI=1S/C18H16N4O3S/c1-11-7-12(2)10-22(9-11)16-15(26-18(25)20-16)8-19-21-17(24)13-5-3-4-6-14(13)23/h3-10H,1-2H3,(H2-,19,20,21,23,24,25)