5-(5-chloranylthiophen-2-yl)-3-cyano-1-(1,2-oxazol-3-ylmethyl)indole-2-carboxylic acid

Systemtic Name: 5-(5-chloranylthiophen-2-yl)-3-cyano-1-(1,2-oxazol-3-ylmethyl)indole-2-carboxylic acid Openeye Name: 5-(5-chloro-2-thienyl)-3-cyano-1-(isoxazol-3-ylmethyl)indole-2-carboxylic acid CAS Name: 5-(5-chloro-2-thiophenyl)-3-cyano-1-(3-isoxazolylmethyl)-2-indolecarboxylic acid IUPAC Name: 5-(5-chlorothiophen-2-yl)-3-cyano-1-(1,2-oxazol-3-ylmethyl)indole-2-carboxylic acid Traditional Name: 5-(5-chloro-2-thienyl)-3-cyano-1-(isoxazol-3-ylmethyl)indole-2-carboxylic acid Formula: C18H10ClN3O3S MolecularWeight: 383.8083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C3=CC=C(S3)Cl)C(=C(N2CC4=NOC=C4)C(=O)O)C#N

Isomeric SMILES

C1=CC2=C(C=C1C3=CC=C(S3)Cl)C(=C(N2CC4=NOC=C4)C(=O)O)C#N

InChI

InChI=1S/C18H10ClN3O3S/c19-16-4-3-15(26-16)10-1-2-14-12(7-10)13(8-20)17(18(23)24)22(14)9-11-5-6-25-21-11/h1-7H,9H2,(H,23,24)