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

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[(4-phenylthiophen-3-yl)amino]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[(4-phenyl-3-thienyl)amino]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[(4-phenyl-3-thiophenyl)amino]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[(4-phenylthiophen-3-yl)amino]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[(4-phenyl-3-thienyl)amino]valeramide Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3OS/c1-13(2)10-16(18(22)20-9-8-19)21-17-12-23-11-15(17)14-6-4-3-5-7-14/h3-7,11-13,16,21H,9-10H2,1-2H3,(H,20,22)