N-[4-(4-bromophenyl)sulfanylphenyl]-3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-[4-(4-bromophenyl)sulfanylphenyl]-3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-[4-(4-bromophenyl)sulfanylphenyl]-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide CAS Name: N-[4-[(4-bromophenyl)thio]phenyl]-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide IUPAC Name: N-[4-(4-bromophenyl)sulfanylphenyl]-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-[4-[(4-bromophenyl)thio]phenyl]-3-(2-keto-1,3-benzoxazol-3-yl)propionamide Formula: C22H17BrN2O3S MolecularWeight: 469.35098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)O2)CCC(=O)NC3=CC=C(C=C3)SC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)O2)CCC(=O)NC3=CC=C(C=C3)SC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H17BrN2O3S/c23-15-5-9-17(10-6-15)29-18-11-7-16(8-12-18)24-21(26)13-14-25-19-3-1-2-4-20(19)28-22(25)27/h1-12H,13-14H2,(H,24,26)