[4-[(E)-[(3-methylphenyl)carbonylhydrazinylidene]methyl]phenyl] 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [4-[(E)-[(3-methylphenyl)carbonylhydrazinylidene]methyl]phenyl] 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: [4-[(E)-[(3-methylbenzoyl)hydrazono]methyl]phenyl] 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid [4-[(E)-[[(3-methylphenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(3-methylbenzoyl)hydrazinylidene]methyl]phenyl] 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid [4-[(E)-(m-toluoylhydrazono)methyl]phenyl] ester Formula: C24H17ClN2O3S MolecularWeight: 448.92138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N/N=C/C2=CC=C(C=C2)OC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C24H17ClN2O3S/c1-15-5-4-6-17(13-15)23(28)27-26-14-16-9-11-18(12-10-16)30-24(29)22-21(25)19-7-2-3-8-20(19)31-22/h2-14H,1H3,(H,27,28)/b26-14+