N-[3-[(4-tert-butylphenyl)carbonylamino]phenyl]-3,6-bis(chloranyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-[3-[(4-tert-butylphenyl)carbonylamino]phenyl]-3,6-bis(chloranyl)-1-benzothiophene-2-carboxamide Openeye Name: N-[3-[(4-tert-butylbenzoyl)amino]phenyl]-3,6-dichloro-benzothiophene-2-carboxamide CAS Name: N-[3-[[(4-tert-butylphenyl)-oxomethyl]amino]phenyl]-3,6-dichloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[3-[(4-tert-butylbenzoyl)amino]phenyl]-3,6-dichloro-1-benzothiophene-2-carboxamide Traditional Name: N-[3-[(4-tert-butylbenzoyl)amino]phenyl]-3,6-dichloro-benzothiophene-2-carboxamide Formula: C26H22Cl2N2O2S MolecularWeight: 497.43608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

InChI

InChI=1S/C26H22Cl2N2O2S/c1-26(2,3)16-9-7-15(8-10-16)24(31)29-18-5-4-6-19(14-18)30-25(32)23-22(28)20-12-11-17(27)13-21(20)33-23/h4-14H,1-3H3,(H,29,31)(H,30,32)