4-[[5-(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanylmethyl]-3-nitro-benzamide

Systemtic Name: 4-[[5-(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanylmethyl]-3-nitro-benzamide Openeye Name: 4-[[5-(4-chlorophenyl)oxazol-2-yl]sulfanylmethyl]-3-nitro-benzamide CAS Name: 4-[[[5-(4-chlorophenyl)-2-oxazolyl]thio]methyl]-3-nitrobenzamide IUPAC Name: 4-[[5-(4-chlorophenyl)-1,3-oxazol-2-yl]sulfanylmethyl]-3-nitrobenzamide Traditional Name: 4-[[[5-(4-chlorophenyl)oxazol-2-yl]thio]methyl]-3-nitro-benzamide Formula: C17H12ClN3O4S MolecularWeight: 389.81288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CN=C(O2)SCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CN=C(O2)SCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H12ClN3O4S/c18-13-5-3-10(4-6-13)15-8-20-17(25-15)26-9-12-2-1-11(16(19)22)7-14(12)21(23)24/h1-8H,9H2,(H2,19,22)