3-chloranyl-N-[2-[[2-(dimethylaminomethyl)phenyl]methylamino]-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-[[2-(dimethylaminomethyl)phenyl]methylamino]-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-[[2-(dimethylaminomethyl)phenyl]methylamino]-2-oxo-ethyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[[2-(dimethylaminomethyl)phenyl]methylamino]-2-oxoethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-[[2-(dimethylaminomethyl)phenyl]methylamino]-2-oxoethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-[[2-(dimethylaminomethyl)benzyl]amino]-2-keto-ethyl]benzothiophene-2-carboxamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-25(2)13-15-8-4-3-7-14(15)11-23-18(26)12-24-21(27)20-19(22)16-9-5-6-10-17(16)28-20/h3-10H,11-13H2,1-2H3,(H,23,26)(H,24,27)