2-bromanyl-N-[1-[(3-chloranyl-4-propan-2-yloxy-phenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[1-[(3-chloranyl-4-propan-2-yloxy-phenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-bromo-N-[1-[(3-chloro-4-isopropoxy-phenyl)carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-bromo-N-[1-(3-chloro-4-propan-2-yloxyanilino)-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-bromo-N-[1-(3-chloro-4-propan-2-yloxyanilino)-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-bromo-N-[1-[(3-chloro-4-isopropoxy-phenyl)carbamoyl]-3-(methylthio)propyl]benzamide Formula: C21H24BrClN2O3S MolecularWeight: 499.84886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Br)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Br)Cl

InChI

InChI=1S/C21H24BrClN2O3S/c1-13(2)28-19-9-8-14(12-17(19)23)24-21(27)18(10-11-29-3)25-20(26)15-6-4-5-7-16(15)22/h4-9,12-13,18H,10-11H2,1-3H3,(H,24,27)(H,25,26)