N-tert-butyl-3-chloranyl-7-[(3-methoxyphenyl)carbonylamino]-1-benzothiophene-2-carboxamide

Systemtic Name: N-tert-butyl-3-chloranyl-7-[(3-methoxyphenyl)carbonylamino]-1-benzothiophene-2-carboxamide Openeye Name: N-tert-butyl-3-chloro-7-[(3-methoxybenzoyl)amino]benzothiophene-2-carboxamide CAS Name: N-tert-butyl-3-chloro-7-[[(3-methoxyphenyl)-oxomethyl]amino]-1-benzothiophene-2-carboxamide IUPAC Name: N-tert-butyl-3-chloro-7-[(3-methoxybenzoyl)amino]-1-benzothiophene-2-carboxamide Traditional Name: N-tert-butyl-3-chloro-7-(m-anisoylamino)benzothiophene-2-carboxamide Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=C(C2=C(S1)C(=CC=C2)NC(=O)C3=CC(=CC=C3)OC)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=C(C2=C(S1)C(=CC=C2)NC(=O)C3=CC(=CC=C3)OC)Cl

InChI

InChI=1S/C21H21ClN2O3S/c1-21(2,3)24-20(26)18-16(22)14-9-6-10-15(17(14)28-18)23-19(25)12-7-5-8-13(11-12)27-4/h5-11H,1-4H3,(H,23,25)(H,24,26)