4,6-dimethyl-2-[(2S)-1-[(4-morpholin-4-ylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-pyridine-3-carboxamide

Systemtic Name: 4,6-dimethyl-2-[(2S)-1-[(4-morpholin-4-ylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-pyridine-3-carboxamide Openeye Name: 4,6-dimethyl-2-[(1S)-1-methyl-2-(4-morpholinoanilino)-2-oxo-ethyl]sulfanyl-pyridine-3-carboxamide CAS Name: 4,6-dimethyl-2-[[(2S)-1-[4-(4-morpholinyl)anilino]-1-oxopropan-2-yl]thio]-3-pyridinecarboxamide IUPAC Name: 4,6-dimethyl-2-[(2S)-1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl]sulfanylpyridine-3-carboxamide Traditional Name: 2-[[(1S)-2-keto-1-methyl-2-(4-morpholinoanilino)ethyl]thio]-4,6-dimethyl-nicotinamide Formula: C21H26N4O3S MolecularWeight: 414.52114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)N)SC(C)C(=O)NC2=CC=C(C=C2)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)N)S[C@@H](C)C(=O)NC2=CC=C(C=C2)N3CCOCC3)C

InChI

InChI=1S/C21H26N4O3S/c1-13-12-14(2)23-21(18(13)19(22)26)29-15(3)20(27)24-16-4-6-17(7-5-16)25-8-10-28-11-9-25/h4-7,12,15H,8-11H2,1-3H3,(H2,22,26)(H,24,27)/t15-/m0/s1