propan-2-yl (6R)-2-[3-(4-methoxyphenyl)propanoylamino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: propan-2-yl (6R)-2-[3-(4-methoxyphenyl)propanoylamino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: isopropyl (6R)-2-[3-(4-methoxyphenyl)propanoylamino]-6-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (6R)-2-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (6R)-2-[3-(4-methoxyphenyl)propanoylamino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (6R)-2-[3-(4-methoxyphenyl)propanoylamino]-6-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid isopropyl ester Formula: C28H31NO4S MolecularWeight: 477.61504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(SC2=C1CCC(C2)C3=CC=CC=C3)NC(=O)CCC4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)OC(=O)C1=C(SC2=C1CC[C@H](C2)C3=CC=CC=C3)NC(=O)CCC4=CC=C(C=C4)OC

InChI

InChI=1S/C28H31NO4S/c1-18(2)33-28(31)26-23-15-12-21(20-7-5-4-6-8-20)17-24(23)34-27(26)29-25(30)16-11-19-9-13-22(32-3)14-10-19/h4-10,13-14,18,21H,11-12,15-17H2,1-3H3,(H,29,30)/t21-/m1/s1