N-(furan-2-ylmethyl)-6-(2-methylbutan-2-yl)-2-(3-phenylprop-2-ynoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-6-(2-methylbutan-2-yl)-2-(3-phenylprop-2-ynoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 6-(1,1-dimethylpropyl)-N-(2-furylmethyl)-2-(3-phenylprop-2-ynoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(2-furanylmethyl)-6-(2-methylbutan-2-yl)-2-[(1-oxo-3-phenylprop-2-ynyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(furan-2-ylmethyl)-6-(2-methylbutan-2-yl)-2-(3-phenylprop-2-ynoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 6-tert-amyl-N-(2-furfuryl)-2-[(3-phenylpropioloyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C28H30N2O3S MolecularWeight: 474.6144

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NCC3=CC=CO3)NC(=O)C#CC4=CC=CC=C4

Isomeric SMILES

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NCC3=CC=CO3)NC(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C28H30N2O3S/c1-4-28(2,3)20-13-14-22-23(17-20)34-27(25(22)26(32)29-18-21-11-8-16-33-21)30-24(31)15-12-19-9-6-5-7-10-19/h5-11,16,20H,4,13-14,17-18H2,1-3H3,(H,29,32)(H,30,31)