4-[5-(4-phenylbutanoylamino)pyrazol-1-yl]-N-prop-2-enyl-piperidine-1-carboxamide

Systemtic Name: 4-[5-(4-phenylbutanoylamino)pyrazol-1-yl]-N-prop-2-enyl-piperidine-1-carboxamide Openeye Name: N-allyl-4-[5-(4-phenylbutanoylamino)pyrazol-1-yl]piperidine-1-carboxamide CAS Name: 4-[5-[(1-oxo-4-phenylbutyl)amino]-1-pyrazolyl]-N-prop-2-enyl-1-piperidinecarboxamide IUPAC Name: 4-[5-(4-phenylbutanoylamino)pyrazol-1-yl]-N-prop-2-enylpiperidine-1-carboxamide Traditional Name: N-allyl-4-[5-(4-phenylbutanoylamino)pyrazol-1-yl]piperidine-1-carboxamide Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)CCCC3=CC=CC=C3

Isomeric SMILES

C=CCNC(=O)N1CCC(CC1)N2C(=CC=N2)NC(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C22H29N5O2/c1-2-14-23-22(29)26-16-12-19(13-17-26)27-20(11-15-24-27)25-21(28)10-6-9-18-7-4-3-5-8-18/h2-5,7-8,11,15,19H,1,6,9-10,12-14,16-17H2,(H,23,29)(H,25,28)