2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]ethanamide

Systemtic Name: 2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]ethanamide Openeye Name: 2-[2-(4-methoxyanilino)-2-oxo-ethyl]sulfanyl-N-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]acetamide CAS Name: 2-[[2-(4-methoxyanilino)-2-oxoethyl]thio]-N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]acetamide IUPAC Name: 2-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-N-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]acetamide Traditional Name: 2-[[2-keto-2-(p-anisidino)ethyl]thio]-N-[(6-pyrrolidino-3-pyridyl)methyl]acetamide Formula: C21H26N4O3S MolecularWeight: 414.52114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSCC(=O)NCC2=CN=C(C=C2)N3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSCC(=O)NCC2=CN=C(C=C2)N3CCCC3

InChI

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