4-(aminomethyl)-N-[(1S)-1-(4-butylpyridin-2-yl)-2-cyclohexyl-ethyl]benzamide

Systemtic Name: 4-(aminomethyl)-N-[(1S)-1-(4-butylpyridin-2-yl)-2-cyclohexyl-ethyl]benzamide Openeye Name: 4-(aminomethyl)-N-[(1S)-1-(4-butyl-2-pyridyl)-2-cyclohexyl-ethyl]benzamide CAS Name: 4-(aminomethyl)-N-[(1S)-1-(4-butyl-2-pyridinyl)-2-cyclohexylethyl]benzamide IUPAC Name: 4-(aminomethyl)-N-[(1S)-1-(4-butylpyridin-2-yl)-2-cyclohexylethyl]benzamide Traditional Name: 4-(aminomethyl)-N-[(1S)-1-(4-butyl-2-pyridyl)-2-cyclohexyl-ethyl]benzamide Formula: C25H35N3O MolecularWeight: 393.5649

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=NC=C1)C(CC2CCCCC2)NC(=O)C3=CC=C(C=C3)CN

Isomeric SMILES

CCCCC1=CC(=NC=C1)[C@H](CC2CCCCC2)NC(=O)C3=CC=C(C=C3)CN

InChI

InChI=1S/C25H35N3O/c1-2-3-7-20-14-15-27-23(16-20)24(17-19-8-5-4-6-9-19)28-25(29)22-12-10-21(18-26)11-13-22/h10-16,19,24H,2-9,17-18,26H2,1H3,(H,28,29)/t24-/m0/s1