3-chloranyl-N-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(3,4-diethoxyanilino)-2-oxo-ethyl]-N-methyl-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N-methyl-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N-methyl-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-(3,4-diethoxyanilino)-2-keto-ethyl]-N-methyl-benzothiophene-2-carboxamide Formula: C22H23ClN2O4S MolecularWeight: 446.94702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CN(C)C(=O)C2=C(C3=CC=CC=C3S2)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CN(C)C(=O)C2=C(C3=CC=CC=C3S2)Cl)OCC

InChI

InChI=1S/C22H23ClN2O4S/c1-4-28-16-11-10-14(12-17(16)29-5-2)24-19(26)13-25(3)22(27)21-20(23)15-8-6-7-9-18(15)30-21/h6-12H,4-5,13H2,1-3H3,(H,24,26)