N-[2-[[4-(tert-butylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-[[4-(tert-butylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[2-[4-(tert-butylcarbamoyl)anilino]-2-oxo-ethyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[2-[4-[(tert-butylamino)-oxomethyl]anilino]-2-oxoethyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-[4-(tert-butylcarbamoyl)anilino]-2-oxoethyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-[4-(tert-butylcarbamoyl)anilino]-2-keto-ethyl]-3-chloro-benzothiophene-2-carboxamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C22H22ClN3O3S/c1-22(2,3)26-20(28)13-8-10-14(11-9-13)25-17(27)12-24-21(29)19-18(23)15-6-4-5-7-16(15)30-19/h4-11H,12H2,1-3H3,(H,24,29)(H,25,27)(H,26,28)