N-(cyanomethyl)-2-[[4-(3-fluorophenyl)thiophen-3-yl]amino]-4-methyl-pentanamide

Systemtic Name: N-(cyanomethyl)-2-[[4-(3-fluorophenyl)thiophen-3-yl]amino]-4-methyl-pentanamide Openeye Name: N-(cyanomethyl)-2-[[4-(3-fluorophenyl)-3-thienyl]amino]-4-methyl-pentanamide CAS Name: N-(cyanomethyl)-2-[[4-(3-fluorophenyl)-3-thiophenyl]amino]-4-methylpentanamide IUPAC Name: N-(cyanomethyl)-2-[[4-(3-fluorophenyl)thiophen-3-yl]amino]-4-methylpentanamide Traditional Name: N-(cyanomethyl)-2-[[4-(3-fluorophenyl)-3-thienyl]amino]-4-methyl-valeramide Formula: C18H20FN3OS MolecularWeight: 345.434303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20FN3OS/c1-12(2)8-16(18(23)21-7-6-20)22-17-11-24-10-15(17)13-4-3-5-14(19)9-13/h3-5,9-12,16,22H,7-8H2,1-2H3,(H,21,23)