2-[[4-(1-benzothiophen-2-ylcarbonylamino)-3-methyl-phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-(1-benzothiophen-2-ylcarbonylamino)-3-methyl-phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-(benzothiophene-2-carbonylamino)-3-methyl-benzoyl]amino]acetic acid CAS Name: 2-[[[4-[[1-benzothiophen-2-yl(oxo)methyl]amino]-3-methylphenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-(1-benzothiophene-2-carbonylamino)-3-methylbenzoyl]amino]acetic acid Traditional Name: 2-[[4-(benzothiophene-2-carbonylamino)-3-methyl-benzoyl]amino]acetic acid Formula: C19H16N2O4S MolecularWeight: 368.40634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC(=O)O)NC(=O)C2=CC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC(=O)O)NC(=O)C2=CC3=CC=CC=C3S2

InChI

InChI=1S/C19H16N2O4S/c1-11-8-13(18(24)20-10-17(22)23)6-7-14(11)21-19(25)16-9-12-4-2-3-5-15(12)26-16/h2-9H,10H2,1H3,(H,20,24)(H,21,25)(H,22,23)