5-bromanyl-2-methoxy-N-[[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-3-methyl-benzamide

Systemtic Name: 5-bromanyl-2-methoxy-N-[[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-3-methyl-benzamide Openeye Name: 5-bromo-2-methoxy-N-[[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-3-methyl-benzamide CAS Name: 5-bromo-2-methoxy-N-[[[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-3-methylbenzamide IUPAC Name: 5-bromo-2-methoxy-N-[[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-3-methylbenzamide Traditional Name: 5-bromo-2-methoxy-N-[[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]-3-methyl-benzamide Formula: C24H20BrN3O4S MolecularWeight: 526.4023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)OC)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)OC)OC

InChI

InChI=1S/C24H20BrN3O4S/c1-13-10-15(25)11-18(21(13)31-3)22(29)28-24(33)26-16-6-9-20-19(12-16)27-23(32-20)14-4-7-17(30-2)8-5-14/h4-12H,1-3H3,(H2,26,28,29,33)