N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[ethyl-(phenylmethyl)amino]ethanamide

Systemtic Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[ethyl-(phenylmethyl)amino]ethanamide Openeye Name: 2-[benzyl(ethyl)amino]-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide CAS Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[ethyl-(phenylmethyl)amino]acetamide IUPAC Name: 2-[benzyl(ethyl)amino]-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide Traditional Name: 2-[benzyl(ethyl)amino]-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)CC(=O)NC2=C(C3=C(S2)CC(CC3)C)C#N

Isomeric SMILES

CCN(CC1=CC=CC=C1)CC(=O)NC2=C(C3=C(S2)CC(CC3)C)C#N

InChI

InChI=1S/C21H25N3OS/c1-3-24(13-16-7-5-4-6-8-16)14-20(25)23-21-18(12-22)17-10-9-15(2)11-19(17)26-21/h4-8,15H,3,9-11,13-14H2,1-2H3,(H,23,25)