4-(3,4-dimethylphenyl)-2-(2-naphthalen-1-ylethanoylamino)thiophene-3-carboxylic acid

Systemtic Name: 4-(3,4-dimethylphenyl)-2-(2-naphthalen-1-ylethanoylamino)thiophene-3-carboxylic acid Openeye Name: 4-(3,4-dimethylphenyl)-2-[[2-(1-naphthyl)acetyl]amino]thiophene-3-carboxylic acid CAS Name: 4-(3,4-dimethylphenyl)-2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4-(3,4-dimethylphenyl)-2-[(2-naphthalen-1-ylacetyl)amino]thiophene-3-carboxylic acid Traditional Name: 4-(3,4-dimethylphenyl)-2-[[2-(1-naphthyl)acetyl]amino]-3-thenoic acid Formula: C25H21NO3S MolecularWeight: 415.50414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=C2C(=O)O)NC(=O)CC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=C2C(=O)O)NC(=O)CC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C25H21NO3S/c1-15-10-11-19(12-16(15)2)21-14-30-24(23(21)25(28)29)26-22(27)13-18-8-5-7-17-6-3-4-9-20(17)18/h3-12,14H,13H2,1-2H3,(H,26,27)(H,28,29)