N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(3-methylbutoxy)benzamide

Systemtic Name: N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(3-methylbutoxy)benzamide Openeye Name: N-(3-cyano-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-isopentyloxy-benzamide CAS Name: N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(3-methylbutoxy)benzamide IUPAC Name: N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(3-methylbutoxy)benzamide Traditional Name: N-(3-cyano-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-isoamoxy-benzamide Formula: C22H26N2O2S MolecularWeight: 382.51904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(C=C3)OCCC(C)C)C#N

Isomeric SMILES

CC1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(C=C3)OCCC(C)C)C#N

InChI

InChI=1S/C22H26N2O2S/c1-14(2)10-11-26-17-7-5-16(6-8-17)21(25)24-22-19(13-23)18-12-15(3)4-9-20(18)27-22/h5-8,14-15H,4,9-12H2,1-3H3,(H,24,25)