[1-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]naphthalen-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [1-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]naphthalen-2-yl] 4-methylbenzenesulfonate Openeye Name: [1-[(2-amino-4-oxo-thiazol-5-ylidene)methyl]-2-naphthyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-[(2-amino-4-oxo-5-thiazolylidene)methyl]-2-naphthalenyl] ester IUPAC Name: [1-[(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]naphthalen-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [1-[(2-amino-4-keto-2-thiazolin-5-ylidene)methyl]-2-naphthyl] ester Formula: C21H16N2O4S2 MolecularWeight: 424.49274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C3=CC=CC=C3C=C2)C=C4C(=O)N=C(S4)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C3=CC=CC=C3C=C2)C=C4C(=O)N=C(S4)N

InChI

InChI=1S/C21H16N2O4S2/c1-13-6-9-15(10-7-13)29(25,26)27-18-11-8-14-4-2-3-5-16(14)17(18)12-19-20(24)23-21(22)28-19/h2-12H,1H3,(H2,22,23,24)