6-tert-butyl-N-(4-ethylphenyl)-2-[2-(3-methylphenyl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 6-tert-butyl-N-(4-ethylphenyl)-2-[2-(3-methylphenyl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 6-tert-butyl-N-(4-ethylphenyl)-2-[[2-(m-tolyl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 6-tert-butyl-N-(4-ethylphenyl)-2-[[2-(3-methylphenyl)-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 6-tert-butyl-N-(4-ethylphenyl)-2-[[2-(3-methylphenyl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 6-tert-butyl-N-(4-ethylphenyl)-2-[[2-(m-tolyl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C30H36N2O2S MolecularWeight: 488.68404

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC(C3)C(C)(C)C)NC(=O)CC4=CC=CC(=C4)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC(C3)C(C)(C)C)NC(=O)CC4=CC=CC(=C4)C

InChI

InChI=1S/C30H36N2O2S/c1-6-20-10-13-23(14-11-20)31-28(34)27-24-15-12-22(30(3,4)5)18-25(24)35-29(27)32-26(33)17-21-9-7-8-19(2)16-21/h7-11,13-14,16,22H,6,12,15,17-18H2,1-5H3,(H,31,34)(H,32,33)