5-[(3,4-dimethoxyphenyl)methylcarbamoyl]-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid

Systemtic Name: 5-[(3,4-dimethoxyphenyl)methylcarbamoyl]-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid Openeye Name: 5-[(3,4-dimethoxyphenyl)methylcarbamoyl]-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid CAS Name: 5-[[(3,4-dimethoxyphenyl)methylamino]-oxomethyl]-4-methyl-2-[[(octylamino)-oxomethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 5-[(3,4-dimethoxyphenyl)methylcarbamoyl]-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid Traditional Name: 4-methyl-2-(octylcarbamoylamino)-5-(veratrylcarbamoyl)-3-thenoic acid Formula: C25H35N3O6S MolecularWeight: 505.6269

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)NC1=C(C(=C(S1)C(=O)NCC2=CC(=C(C=C2)OC)OC)C)C(=O)O

Isomeric SMILES

CCCCCCCCNC(=O)NC1=C(C(=C(S1)C(=O)NCC2=CC(=C(C=C2)OC)OC)C)C(=O)O

InChI

InChI=1S/C25H35N3O6S/c1-5-6-7-8-9-10-13-26-25(32)28-23-20(24(30)31)16(2)21(35-23)22(29)27-15-17-11-12-18(33-3)19(14-17)34-4/h11-12,14H,5-10,13,15H2,1-4H3,(H,27,29)(H,30,31)(H2,26,28,32)