N-[[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]sulfanylcarbamoyl]benzamide

Systemtic Name: N-[[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]sulfanylcarbamoyl]benzamide Openeye Name: N-[[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]sulfanylcarbamoyl]benzamide CAS Name: N-[[[[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]thio]amino]-oxomethyl]benzamide IUPAC Name: N-[[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]sulfanylcarbamoyl]benzamide Traditional Name: N-[[[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]thio]carbamoyl]benzamide Formula: C21H14ClN3O3S MolecularWeight: 423.87216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=O)NSC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=O)NSC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H14ClN3O3S/c22-15-8-6-14(7-9-15)20-23-17-12-16(10-11-18(17)28-20)29-25-21(27)24-19(26)13-4-2-1-3-5-13/h1-12H,(H2,24,25,26,27)