N-[4-oxidanylidene-4-[(5-piperidin-1-ylisoquinolin-8-yl)amino]butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-oxidanylidene-4-[(5-piperidin-1-ylisoquinolin-8-yl)amino]butyl]thiophene-3-carboxamide Openeye Name: N-[4-oxo-4-[[5-(1-piperidyl)-8-isoquinolyl]amino]butyl]thiophene-3-carboxamide CAS Name: N-[4-oxo-4-[[5-(1-piperidinyl)-8-isoquinolinyl]amino]butyl]-3-thiophenecarboxamide IUPAC Name: N-[4-oxo-4-[(5-piperidin-1-ylisoquinolin-8-yl)amino]butyl]thiophene-3-carboxamide Traditional Name: N-[4-keto-4-[(5-piperidino-8-isoquinolyl)amino]butyl]thiophene-3-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=CSC=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O2S/c28-22(5-4-10-25-23(29)17-9-14-30-16-17)26-20-6-7-21(27-12-2-1-3-13-27)18-8-11-24-15-19(18)20/h6-9,11,14-16H,1-5,10,12-13H2,(H,25,29)(H,26,28)