2-[2-(4-carbamothioylphenyl)-7-formamido-imidazo[1,2-a]pyridin-3-yl]propanoic acid

Systemtic Name: 2-[2-(4-carbamothioylphenyl)-7-formamido-imidazo[1,2-a]pyridin-3-yl]propanoic acid Openeye Name: 2-[2-(4-carbamothioylphenyl)-7-formamido-imidazo[1,2-a]pyridin-3-yl]propanoic acid CAS Name: 2-[2-(4-carbamothioylphenyl)-7-formamido-3-imidazo[1,2-a]pyridinyl]propanoic acid IUPAC Name: 2-[2-(4-carbamothioylphenyl)-7-formamidoimidazo[1,2-a]pyridin-3-yl]propanoic acid Traditional Name: 2-[7-formamido-2-(4-thiocarbamoylphenyl)imidazo[1,2-a]pyridin-3-yl]propionic acid Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(N=C2N1C=CC(=C2)NC=O)C3=CC=C(C=C3)C(=S)N)C(=O)O

Isomeric SMILES

CC(C1=C(N=C2N1C=CC(=C2)NC=O)C3=CC=C(C=C3)C(=S)N)C(=O)O

InChI

InChI=1S/C18H16N4O3S/c1-10(18(24)25)16-15(11-2-4-12(5-3-11)17(19)26)21-14-8-13(20-9-23)6-7-22(14)16/h2-10H,1H3,(H2,19,26)(H,20,23)(H,24,25)