2-[3-[(2-acetamido-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(2-acetamido-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]indol-1-yl]ethanoic acid Openeye Name: 2-[3-[(2-acetamido-4-oxo-thiazol-5-ylidene)methyl]indol-1-yl]acetic acid CAS Name: 2-[3-[(2-acetamido-4-oxo-5-thiazolylidene)methyl]-1-indolyl]acetic acid IUPAC Name: 2-[3-[(2-acetamido-4-oxo-1,3-thiazol-5-ylidene)methyl]indol-1-yl]acetic acid Traditional Name: 2-[3-[(2-acetamido-4-keto-2-thiazolin-5-ylidene)methyl]indol-1-yl]acetic acid Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)O)S1

Isomeric SMILES

CC(=O)NC1=NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)O)S1

InChI

InChI=1S/C16H13N3O4S/c1-9(20)17-16-18-15(23)13(24-16)6-10-7-19(8-14(21)22)12-5-3-2-4-11(10)12/h2-7H,8H2,1H3,(H,21,22)(H,17,18,20,23)