methyl 6-tert-butyl-2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 6-tert-butyl-2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 6-tert-butyl-2-[2-(4-methyl-2-oxo-chromen-7-yl)oxypropanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-tert-butyl-2-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 6-tert-butyl-2-[2-(4-methyl-2-oxochromen-7-yl)oxypropanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 6-tert-butyl-2-[2-(2-keto-4-methyl-chromen-7-yl)oxypropanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C27H31NO6S MolecularWeight: 497.60314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)NC3=C(C4=C(S3)CC(CC4)C(C)(C)C)C(=O)OC

InChI

InChI=1S/C27H31NO6S/c1-14-11-22(29)34-20-13-17(8-10-18(14)20)33-15(2)24(30)28-25-23(26(31)32-6)19-9-7-16(27(3,4)5)12-21(19)35-25/h8,10-11,13,15-16H,7,9,12H2,1-6H3,(H,28,30)