N-(2-aminophenyl)-5-(2-pyrrolidin-1-ylethanoylamino)-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-5-(2-pyrrolidin-1-ylethanoylamino)-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-5-[(2-pyrrolidin-1-ylacetyl)amino]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-5-[[1-oxo-2-(1-pyrrolidinyl)ethyl]amino]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-5-[(2-pyrrolidin-1-ylacetyl)amino]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-5-[(2-pyrrolidinoacetyl)amino]benzothiophene-2-carboxamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(=O)NC2=CC3=C(C=C2)SC(=C3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

C1CCN(C1)CC(=O)NC2=CC3=C(C=C2)SC(=C3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C21H22N4O2S/c22-16-5-1-2-6-17(16)24-21(27)19-12-14-11-15(7-8-18(14)28-19)23-20(26)13-25-9-3-4-10-25/h1-2,5-8,11-12H,3-4,9-10,13,22H2,(H,23,26)(H,24,27)