3-chloranyl-N-[4-[3-(dimethylamino)pyrrolidin-1-yl]carbonylphenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-[3-(dimethylamino)pyrrolidin-1-yl]carbonylphenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-[3-(dimethylamino)pyrrolidine-1-carbonyl]phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-[[3-(dimethylamino)-1-pyrrolidinyl]-oxomethyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-[3-(dimethylamino)pyrrolidine-1-carbonyl]phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-[3-(dimethylamino)pyrrolidine-1-carbonyl]phenyl]benzothiophene-2-carboxamide Formula: C22H22ClN3O2S MolecularWeight: 427.94698

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(C1)C(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CN(C)C1CCN(C1)C(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C22H22ClN3O2S/c1-25(2)16-11-12-26(13-16)22(28)14-7-9-15(10-8-14)24-21(27)20-19(23)17-5-3-4-6-18(17)29-20/h3-10,16H,11-13H2,1-2H3,(H,24,27)