2-[2-[5-azanyl-4-(4-methoxyphenyl)pyrazol-1-yl]-4-phenyl-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[2-[5-azanyl-4-(4-methoxyphenyl)pyrazol-1-yl]-4-phenyl-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[2-[5-amino-4-(4-methoxyphenyl)pyrazol-1-yl]-4-phenyl-thiazol-5-yl]acetic acid CAS Name: 2-[2-[5-amino-4-(4-methoxyphenyl)-1-pyrazolyl]-4-phenyl-5-thiazolyl]acetic acid IUPAC Name: 2-[2-[5-amino-4-(4-methoxyphenyl)pyrazol-1-yl]-4-phenyl-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-[5-amino-4-(4-methoxyphenyl)pyrazol-1-yl]-4-phenyl-thiazol-5-yl]acetic acid Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N(N=C2)C3=NC(=C(S3)CC(=O)O)C4=CC=CC=C4)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N(N=C2)C3=NC(=C(S3)CC(=O)O)C4=CC=CC=C4)N

InChI

InChI=1S/C21H18N4O3S/c1-28-15-9-7-13(8-10-15)16-12-23-25(20(16)22)21-24-19(14-5-3-2-4-6-14)17(29-21)11-18(26)27/h2-10,12H,11,22H2,1H3,(H,26,27)