N-[3-[[2-(3-chloranylpyridin-2-yl)sulfanylethanoylamino]methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[[2-(3-chloranylpyridin-2-yl)sulfanylethanoylamino]methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[[2-[(3-chloro-2-pyridyl)sulfanyl]acetyl]amino]methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[[2-[(3-chloro-2-pyridinyl)thio]-1-oxoethyl]amino]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[[2-(3-chloropyridin-2-yl)sulfanylacetyl]amino]methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[[2-[(3-chloro-2-pyridyl)thio]acetyl]amino]methyl]phenyl]cyclopropanecarboxamide Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)CSC3=C(C=CC=N3)Cl

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)CSC3=C(C=CC=N3)Cl

InChI

InChI=1S/C18H18ClN3O2S/c19-15-5-2-8-20-18(15)25-11-16(23)21-10-12-3-1-4-14(9-12)22-17(24)13-6-7-13/h1-5,8-9,13H,6-7,10-11H2,(H,21,23)(H,22,24)