5-(4-methylphenyl)-3-(4-phenylbutylcarbamoylamino)thiophene-2-carboxylic acid

Systemtic Name: 5-(4-methylphenyl)-3-(4-phenylbutylcarbamoylamino)thiophene-2-carboxylic acid Openeye Name: 3-(4-phenylbutylcarbamoylamino)-5-(p-tolyl)thiophene-2-carboxylic acid CAS Name: 5-(4-methylphenyl)-3-[[oxo-(4-phenylbutylamino)methyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-(4-methylphenyl)-3-(4-phenylbutylcarbamoylamino)thiophene-2-carboxylic acid Traditional Name: 3-(4-phenylbutylcarbamoylamino)-5-(p-tolyl)-2-thenoic acid Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(S2)C(=O)O)NC(=O)NCCCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(S2)C(=O)O)NC(=O)NCCCCC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O3S/c1-16-10-12-18(13-11-16)20-15-19(21(29-20)22(26)27)25-23(28)24-14-6-5-9-17-7-3-2-4-8-17/h2-4,7-8,10-13,15H,5-6,9,14H2,1H3,(H,26,27)(H2,24,25,28)