N-(5-piperidin-1-ylisoquinolin-8-yl)-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-(5-piperidin-1-ylisoquinolin-8-yl)-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: 4-[(isopropylcarbamoylamino)methyl]-N-[5-(1-piperidyl)-8-isoquinolyl]benzamide CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]-N-[5-(1-piperidinyl)-8-isoquinolinyl]benzamide IUPAC Name: N-(5-piperidin-1-ylisoquinolin-8-yl)-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: 4-[(isopropylcarbamoylamino)methyl]-N-(5-piperidino-8-isoquinolyl)benzamide Formula: C26H31N5O2 MolecularWeight: 445.55664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4

InChI

InChI=1S/C26H31N5O2/c1-18(2)29-26(33)28-16-19-6-8-20(9-7-19)25(32)30-23-10-11-24(31-14-4-3-5-15-31)21-12-13-27-17-22(21)23/h6-13,17-18H,3-5,14-16H2,1-2H3,(H,30,32)(H2,28,29,33)