1-[(2S)-butan-2-yl]-N3-[(5-chloranylthiophen-2-yl)methyl]-4-oxidanylidene-N5-prop-2-enyl-pyridine-3,5-dicarboxamide

Systemtic Name: 1-[(2S)-butan-2-yl]-N3-[(5-chloranylthiophen-2-yl)methyl]-4-oxidanylidene-N5-prop-2-enyl-pyridine-3,5-dicarboxamide Openeye Name: N5-allyl-N3-[(5-chloro-2-thienyl)methyl]-1-[(1S)-1-methylpropyl]-4-oxo-pyridine-3,5-dicarboxamide CAS Name: 1-[(2S)-butan-2-yl]-N3-[(5-chloro-2-thiophenyl)methyl]-4-oxo-N5-prop-2-enylpyridine-3,5-dicarboxamide IUPAC Name: 1-[(2S)-butan-2-yl]-3-N-[(5-chlorothiophen-2-yl)methyl]-4-oxo-5-N-prop-2-enylpyridine-3,5-dicarboxamide Traditional Name: N'-allyl-N-[(5-chloro-2-thienyl)methyl]-4-keto-1-[(1S)-1-methylpropyl]dinicotinamide Formula: C19H22ClN3O3S MolecularWeight: 407.91428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=C(C(=O)C(=C1)C(=O)NCC2=CC=C(S2)Cl)C(=O)NCC=C

Isomeric SMILES

CC[C@H](C)N1C=C(C(=O)C(=C1)C(=O)NCC2=CC=C(S2)Cl)C(=O)NCC=C

InChI

InChI=1S/C19H22ClN3O3S/c1-4-8-21-18(25)14-10-23(12(3)5-2)11-15(17(14)24)19(26)22-9-13-6-7-16(20)27-13/h4,6-7,10-12H,1,5,8-9H2,2-3H3,(H,21,25)(H,22,26)/t12-/m0/s1