2-(3-aminophenyl)sulfanyl-N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenyl-ethanamide

Systemtic Name: 2-(3-aminophenyl)sulfanyl-N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenyl-ethanamide Openeye Name: 2-(3-aminophenyl)sulfanyl-N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenyl-acetamide CAS Name: 2-[(3-aminophenyl)thio]-N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenylacetamide IUPAC Name: 2-(3-aminophenyl)sulfanyl-N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenylacetamide Traditional Name: 2-[(3-aminophenyl)thio]-N-[4-(1,3-benzoxazol-2-yl)phenyl]-2-phenyl-acetamide Formula: C27H21N3O2S MolecularWeight: 451.53954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3)SC5=CC=CC(=C5)N

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3)SC5=CC=CC(=C5)N

InChI

InChI=1S/C27H21N3O2S/c28-20-9-6-10-22(17-20)33-25(18-7-2-1-3-8-18)26(31)29-21-15-13-19(14-16-21)27-30-23-11-4-5-12-24(23)32-27/h1-17,25H,28H2,(H,29,31)