2-[[4-(1-benzothiophen-7-yl)thiophen-3-yl]amino]-N-(cyanomethyl)-4-methyl-pentanamide

Systemtic Name: 2-[[4-(1-benzothiophen-7-yl)thiophen-3-yl]amino]-N-(cyanomethyl)-4-methyl-pentanamide Openeye Name: 2-[[4-(benzothiophen-7-yl)-3-thienyl]amino]-N-(cyanomethyl)-4-methyl-pentanamide CAS Name: 2-[[4-(1-benzothiophen-7-yl)-3-thiophenyl]amino]-N-(cyanomethyl)-4-methylpentanamide IUPAC Name: 2-[[4-(1-benzothiophen-7-yl)thiophen-3-yl]amino]-N-(cyanomethyl)-4-methylpentanamide Traditional Name: 2-[[4-(benzothiophen-7-yl)-3-thienyl]amino]-N-(cyanomethyl)-4-methyl-valeramide Formula: C20H21N3OS2 MolecularWeight: 383.53024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)NC1=CSC=C1C2=CC=CC3=C2SC=C3

Isomeric SMILES

CC(C)CC(C(=O)NCC#N)NC1=CSC=C1C2=CC=CC3=C2SC=C3

InChI

InChI=1S/C20H21N3OS2/c1-13(2)10-17(20(24)22-8-7-21)23-18-12-25-11-16(18)15-5-3-4-14-6-9-26-19(14)15/h3-6,9,11-13,17,23H,8,10H2,1-2H3,(H,22,24)