8-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamoyl]naphthalene-1-carboxylic acid

Systemtic Name: 8-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamoyl]naphthalene-1-carboxylic acid Openeye Name: 8-[[4-(4-chlorophenyl)thiazol-2-yl]carbamoyl]naphthalene-1-carboxylic acid CAS Name: 8-[[[4-(4-chlorophenyl)-2-thiazolyl]amino]-oxomethyl]-1-naphthalenecarboxylic acid IUPAC Name: 8-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamoyl]naphthalene-1-carboxylic acid Traditional Name: 8-[[4-(4-chlorophenyl)thiazol-2-yl]carbamoyl]-1-naphthoic acid Formula: C21H13ClN2O3S MolecularWeight: 408.85752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)Cl)C(=CC=C2)C(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)Cl)C(=CC=C2)C(=O)O

InChI

InChI=1S/C21H13ClN2O3S/c22-14-9-7-12(8-10-14)17-11-28-21(23-17)24-19(25)15-5-1-3-13-4-2-6-16(18(13)15)20(26)27/h1-11H,(H,26,27)(H,23,24,25)