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

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(3-methylbutoxy)benzamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-isopentyloxy-benzamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(3-methylbutoxy)benzamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(3-methylbutoxy)benzamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-isoamoxy-benzamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C21H24N2O2S/c1-14(2)11-12-25-16-9-7-15(8-10-16)20(24)23-21-18(13-22)17-5-3-4-6-19(17)26-21/h7-10,14H,3-6,11-12H2,1-2H3,(H,23,24)