4-[[6-methyl-3-(naphthalen-1-ylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[6-methyl-3-(naphthalen-1-ylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[6-methyl-3-(1-naphthylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[6-methyl-3-[(1-naphthalenylamino)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[6-methyl-3-(naphthalen-1-ylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[[6-methyl-3-(1-naphthylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]butyric acid Formula: C24H24N2O4S MolecularWeight: 436.52336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC4=CC=CC=C43)NC(=O)CCC(=O)O

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC4=CC=CC=C43)NC(=O)CCC(=O)O

InChI

InChI=1S/C24H24N2O4S/c1-14-9-10-17-19(13-14)31-24(26-20(27)11-12-21(28)29)22(17)23(30)25-18-8-4-6-15-5-2-3-7-16(15)18/h2-8,14H,9-13H2,1H3,(H,25,30)(H,26,27)(H,28,29)