[2-[4-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]phenyl]-5-methyl-pyrazol-3-yl] 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-[4-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]phenyl]-5-methyl-pyrazol-3-yl] 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-[4-[(3-chlorobenzothiophene-2-carbonyl)amino]phenyl]-5-methyl-pyrazol-3-yl] 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid [2-[4-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]phenyl]-5-methyl-3-pyrazolyl] ester IUPAC Name: [2-[4-[(3-chloro-1-benzothiophene-2-carbonyl)amino]phenyl]-5-methylpyrazol-3-yl] 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid [2-[4-[(3-chlorobenzothiophene-2-carbonyl)amino]phenyl]-5-methyl-pyrazol-3-yl] ester Formula: C28H17Cl2N3O3S2 MolecularWeight: 578.48888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)OC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4=CC=C(C=C4)NC(=O)C5=C(C6=CC=CC=C6S5)Cl

Isomeric SMILES

CC1=NN(C(=C1)OC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4=CC=C(C=C4)NC(=O)C5=C(C6=CC=CC=C6S5)Cl

InChI

InChI=1S/C28H17Cl2N3O3S2/c1-15-14-22(36-28(35)26-24(30)19-7-3-5-9-21(19)38-26)33(32-15)17-12-10-16(11-13-17)31-27(34)25-23(29)18-6-2-4-8-20(18)37-25/h2-14H,1H3,(H,31,34)