2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 2-[4-(allylcarbamoylamino)-1-piperidyl]-N-(4-pyridylmethyl)benzamide CAS Name: 2-[4-[[oxo-(prop-2-enylamino)methyl]amino]-1-piperidinyl]-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 2-[4-(prop-2-enylcarbamoylamino)piperidin-1-yl]-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 2-[4-(allylcarbamoylamino)piperidino]-N-(4-pyridylmethyl)benzamide Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC1CCN(CC1)C2=CC=CC=C2C(=O)NCC3=CC=NC=C3

Isomeric SMILES

C=CCNC(=O)NC1CCN(CC1)C2=CC=CC=C2C(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C22H27N5O2/c1-2-11-24-22(29)26-18-9-14-27(15-10-18)20-6-4-3-5-19(20)21(28)25-16-17-7-12-23-13-8-17/h2-8,12-13,18H,1,9-11,14-16H2,(H,25,28)(H2,24,26,29)