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

Systemtic Name: 2-[[4-(3-chlorophenyl)thiophen-3-yl]amino]-N-(cyanomethyl)-4-methyl-pentanamide Openeye Name: 2-[[4-(3-chlorophenyl)-3-thienyl]amino]-N-(cyanomethyl)-4-methyl-pentanamide CAS Name: 2-[[4-(3-chlorophenyl)-3-thiophenyl]amino]-N-(cyanomethyl)-4-methylpentanamide IUPAC Name: 2-[[4-(3-chlorophenyl)thiophen-3-yl]amino]-N-(cyanomethyl)-4-methylpentanamide Traditional Name: 2-[[4-(3-chlorophenyl)-3-thienyl]amino]-N-(cyanomethyl)-4-methyl-valeramide Formula: C18H20ClN3OS MolecularWeight: 361.8889

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3OS/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)