N-(3-methoxypropyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(3-methoxypropyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(3-methoxypropyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(3-methoxypropyl)-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(3-methoxypropyl)-2-[[(E)-3-phenylprop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(3-methoxypropyl)-2-[[(E)-3-phenylacryloyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

COCCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3S/c1-27-15-7-14-23-21(26)20-17-10-5-6-11-18(17)28-22(20)24-19(25)13-12-16-8-3-2-4-9-16/h2-4,8-9,12-13H,5-7,10-11,14-15H2,1H3,(H,23,26)(H,24,25)/b13-12+