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

Systemtic Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)amino]ethanamide Openeye Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[tetrahydrofuran-2-ylmethyl(2-thienylmethyl)amino]acetamide CAS Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[2-oxolanylmethyl(thiophen-2-ylmethyl)amino]acetamide IUPAC Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[oxolan-2-ylmethyl(thiophen-2-ylmethyl)amino]acetamide Traditional Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[tetrahydrofurfuryl(2-thenyl)amino]acetamide Formula: C22H27N3O2S2 MolecularWeight: 429.59868

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CN(CC3CCCO3)CC4=CC=CS4

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CN(CC3CCCO3)CC4=CC=CS4

InChI

InChI=1S/C22H27N3O2S2/c1-15-6-7-18-19(11-23)22(29-20(18)10-15)24-21(26)14-25(12-16-4-2-8-27-16)13-17-5-3-9-28-17/h3,5,9,15-16H,2,4,6-8,10,12-14H2,1H3,(H,24,26)