2-[[4-(5-chloranyl-2-methoxy-phenyl)thiophen-3-yl]amino]-N-(cyanomethyl)-4-methyl-pentanamide

Systemtic Name: 2-[[4-(5-chloranyl-2-methoxy-phenyl)thiophen-3-yl]amino]-N-(cyanomethyl)-4-methyl-pentanamide Openeye Name: 2-[[4-(5-chloro-2-methoxy-phenyl)-3-thienyl]amino]-N-(cyanomethyl)-4-methyl-pentanamide CAS Name: 2-[[4-(5-chloro-2-methoxyphenyl)-3-thiophenyl]amino]-N-(cyanomethyl)-4-methylpentanamide IUPAC Name: 2-[[4-(5-chloro-2-methoxyphenyl)thiophen-3-yl]amino]-N-(cyanomethyl)-4-methylpentanamide Traditional Name: 2-[[4-(5-chloro-2-methoxy-phenyl)-3-thienyl]amino]-N-(cyanomethyl)-4-methyl-valeramide Formula: C19H22ClN3O2S MolecularWeight: 391.91488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)NC1=CSC=C1C2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CC(C)CC(C(=O)NCC#N)NC1=CSC=C1C2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C19H22ClN3O2S/c1-12(2)8-16(19(24)22-7-6-21)23-17-11-26-10-15(17)14-9-13(20)4-5-18(14)25-3/h4-5,9-12,16,23H,7-8H2,1-3H3,(H,22,24)