2-[(E)-[4-methyl-3-(naphthalen-1-ylmethyl)-1,3-thiazol-2-ylidene]amino]sulfonylbenzoic acid

Systemtic Name: 2-[(E)-[4-methyl-3-(naphthalen-1-ylmethyl)-1,3-thiazol-2-ylidene]amino]sulfonylbenzoic acid Openeye Name: 2-[(E)-[4-methyl-3-(1-naphthylmethyl)thiazol-2-ylidene]amino]sulfonylbenzoic acid CAS Name: 2-[(E)-[4-methyl-3-(1-naphthalenylmethyl)-2-thiazolylidene]amino]sulfonylbenzoic acid IUPAC Name: 2-[(E)-[4-methyl-3-(naphthalen-1-ylmethyl)-1,3-thiazol-2-ylidene]amino]sulfonylbenzoic acid Traditional Name: 2-[(E)-[4-methyl-3-(1-naphthylmethyl)-4-thiazolin-2-ylidene]amino]sulfonylbenzoic acid Formula: C22H18N2O4S2 MolecularWeight: 438.51932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=NS(=O)(=O)C2=CC=CC=C2C(=O)O)N1CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CS/C(=N/S(=O)(=O)C2=CC=CC=C2C(=O)O)/N1CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H18N2O4S2/c1-15-14-29-22(23-30(27,28)20-12-5-4-11-19(20)21(25)26)24(15)13-17-9-6-8-16-7-2-3-10-18(16)17/h2-12,14H,13H2,1H3,(H,25,26)/b23-22+