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

Systemtic Name: N-(cyanomethyl)-2-[[4-(3-fluoranyl-4-methoxy-phenyl)thiophen-3-yl]amino]-4-methyl-pentanamide Openeye Name: N-(cyanomethyl)-2-[[4-(3-fluoro-4-methoxy-phenyl)-3-thienyl]amino]-4-methyl-pentanamide CAS Name: N-(cyanomethyl)-2-[[4-(3-fluoro-4-methoxyphenyl)-3-thiophenyl]amino]-4-methylpentanamide IUPAC Name: N-(cyanomethyl)-2-[[4-(3-fluoro-4-methoxyphenyl)thiophen-3-yl]amino]-4-methylpentanamide Traditional Name: N-(cyanomethyl)-2-[[4-(3-fluoro-4-methoxy-phenyl)-3-thienyl]amino]-4-methyl-valeramide Formula: C19H22FN3O2S MolecularWeight: 375.460283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22FN3O2S/c1-12(2)8-16(19(24)22-7-6-21)23-17-11-26-10-14(17)13-4-5-18(25-3)15(20)9-13/h4-5,9-12,16,23H,7-8H2,1-3H3,(H,22,24)