N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C21H27NO3S MolecularWeight: 373.50898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2=CC3=C(S2)CCCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](C)NC(=O)C2=CC3=C(S2)CCCC3)OCC

InChI

InChI=1S/C21H27NO3S/c1-4-24-17-11-10-15(12-18(17)25-5-2)14(3)22-21(23)20-13-16-8-6-7-9-19(16)26-20/h10-14H,4-9H2,1-3H3,(H,22,23)/t14-/m0/s1