N-[4-oxidanylidene-4-[(5-piperidin-1-ylisoquinolin-8-yl)amino]butyl]thiophene-2-carboxamide

Systemtic Name: N-[4-oxidanylidene-4-[(5-piperidin-1-ylisoquinolin-8-yl)amino]butyl]thiophene-2-carboxamide Openeye Name: N-[4-oxo-4-[[5-(1-piperidyl)-8-isoquinolyl]amino]butyl]thiophene-2-carboxamide CAS Name: N-[4-oxo-4-[[5-(1-piperidinyl)-8-isoquinolinyl]amino]butyl]-2-thiophenecarboxamide IUPAC Name: N-[4-oxo-4-[(5-piperidin-1-ylisoquinolin-8-yl)amino]butyl]thiophene-2-carboxamide Traditional Name: N-[4-keto-4-[(5-piperidino-8-isoquinolyl)amino]butyl]thiophene-2-carboxamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)CCCNC(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)CCCNC(=O)C4=CC=CS4

InChI

InChI=1S/C23H26N4O2S/c28-22(7-4-11-25-23(29)21-6-5-15-30-21)26-19-8-9-20(27-13-2-1-3-14-27)17-10-12-24-16-18(17)19/h5-6,8-10,12,15-16H,1-4,7,11,13-14H2,(H,25,29)(H,26,28)