(6S)-2-[2-(4-methoxyphenyl)ethanoylamino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: (6S)-2-[2-(4-methoxyphenyl)ethanoylamino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: (6S)-2-[[2-(4-methoxyphenyl)acetyl]amino]-6-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: (6S)-2-[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: (6S)-2-[[2-(4-methoxyphenyl)acetyl]amino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: (6S)-2-[[2-(4-methoxyphenyl)acetyl]amino]-6-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCC[C@H]1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N2O3S/c1-3-4-13-7-10-16-17(11-13)27-21(19(16)20(22)25)23-18(24)12-14-5-8-15(26-2)9-6-14/h5-6,8-9,13H,3-4,7,10-12H2,1-2H3,(H2,22,25)(H,23,24)/t13-/m0/s1