2-[(4-ethylphenyl)carbonylamino]-N-(3-methoxypropyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[(4-ethylphenyl)carbonylamino]-N-(3-methoxypropyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(4-ethylbenzoyl)amino]-N-(3-methoxypropyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[(4-ethylphenyl)-oxomethyl]amino]-N-(3-methoxypropyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(4-ethylbenzoyl)amino]-N-(3-methoxypropyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(4-ethylbenzoyl)amino]-N-(3-methoxypropyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCCCOC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCCCOC

InChI

InChI=1S/C22H28N2O3S/c1-3-15-9-11-16(12-10-15)20(25)24-22-19(21(26)23-13-6-14-27-2)17-7-4-5-8-18(17)28-22/h9-12H,3-8,13-14H2,1-2H3,(H,23,26)(H,24,25)