ethyl 2-[[4-(furan-2-ylmethylamino)-4-oxidanylidene-butanoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-(furan-2-ylmethylamino)-4-oxidanylidene-butanoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[4-(2-furylmethylamino)-4-oxo-butanoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[4-(2-furanylmethylamino)-1,4-dioxobutyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(furan-2-ylmethylamino)-4-oxobutanoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[4-(2-furfurylamino)-4-keto-butanoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCC(=O)NCC3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H24N2O5S/c1-2-26-20(25)18-14-7-3-4-8-15(14)28-19(18)22-17(24)10-9-16(23)21-12-13-6-5-11-27-13/h5-6,11H,2-4,7-10,12H2,1H3,(H,21,23)(H,22,24)