2-bromanyl-N-[1-[(2-methyl-1,3-benzoxazol-5-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[1-[(2-methyl-1,3-benzoxazol-5-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-bromo-N-[1-[(2-methyl-1,3-benzoxazol-5-yl)carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-bromo-N-[1-[(2-methyl-1,3-benzoxazol-5-yl)amino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-bromo-N-[1-[(2-methyl-1,3-benzoxazol-5-yl)amino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-bromo-N-[1-[(2-methyl-1,3-benzoxazol-5-yl)carbamoyl]-3-(methylthio)propyl]benzamide Formula: C20H20BrN3O3S MolecularWeight: 462.3601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(O1)C=CC(=C2)NC(=O)C(CCSC)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CC1=NC2=C(O1)C=CC(=C2)NC(=O)C(CCSC)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C20H20BrN3O3S/c1-12-22-17-11-13(7-8-18(17)27-12)23-20(26)16(9-10-28-2)24-19(25)14-5-3-4-6-15(14)21/h3-8,11,16H,9-10H2,1-2H3,(H,23,26)(H,24,25)