4-chloranyl-N-[(2S)-3-methyl-1-oxidanylidene-1-(pyridin-3-ylmethylamino)butan-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[(2S)-3-methyl-1-oxidanylidene-1-(pyridin-3-ylmethylamino)butan-2-yl]benzamide Openeye Name: 4-chloro-N-[(1S)-2-methyl-1-(3-pyridylmethylcarbamoyl)propyl]benzamide CAS Name: 4-chloro-N-[(2S)-3-methyl-1-oxo-1-(3-pyridinylmethylamino)butan-2-yl]benzamide IUPAC Name: 4-chloro-N-[(2S)-3-methyl-1-oxo-1-(pyridin-3-ylmethylamino)butan-2-yl]benzamide Traditional Name: 4-chloro-N-[(1S)-2-methyl-1-(3-pyridylmethylcarbamoyl)propyl]benzamide Formula: C18H20ClN3O2 MolecularWeight: 345.8233

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CN=CC=C1)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CN=CC=C1)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H20ClN3O2/c1-12(2)16(18(24)21-11-13-4-3-9-20-10-13)22-17(23)14-5-7-15(19)8-6-14/h3-10,12,16H,11H2,1-2H3,(H,21,24)(H,22,23)/t16-/m0/s1