3-chloranyl-N-[2-[3-(2,4-dimethylphenyl)propylamino]-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-[3-(2,4-dimethylphenyl)propylamino]-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-[3-(2,4-dimethylphenyl)propylamino]-2-oxo-ethyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[3-(2,4-dimethylphenyl)propylamino]-2-oxoethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-[3-(2,4-dimethylphenyl)propylamino]-2-oxoethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-[3-(2,4-dimethylphenyl)propylamino]-2-keto-ethyl]benzothiophene-2-carboxamide Formula: C22H23ClN2O2S MolecularWeight: 414.94822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCCNC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)CCCNC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C

InChI

InChI=1S/C22H23ClN2O2S/c1-14-9-10-16(15(2)12-14)6-5-11-24-19(26)13-25-22(27)21-20(23)17-7-3-4-8-18(17)28-21/h3-4,7-10,12H,5-6,11,13H2,1-2H3,(H,24,26)(H,25,27)