5-bromanyl-N-[[3-[ethanoyl(methyl)amino]phenyl]carbamothioyl]-2-(3-methylbutoxy)benzamide

Systemtic Name: 5-bromanyl-N-[[3-[ethanoyl(methyl)amino]phenyl]carbamothioyl]-2-(3-methylbutoxy)benzamide Openeye Name: N-[[3-[acetyl(methyl)amino]phenyl]carbamothioyl]-5-bromo-2-isopentyloxy-benzamide CAS Name: N-[[3-[acetyl(methyl)amino]anilino]-sulfanylidenemethyl]-5-bromo-2-(3-methylbutoxy)benzamide IUPAC Name: N-[[3-[acetyl(methyl)amino]phenyl]carbamothioyl]-5-bromo-2-(3-methylbutoxy)benzamide Traditional Name: N-[[3-[acetyl(methyl)amino]phenyl]thiocarbamoyl]-5-bromo-2-isoamoxy-benzamide Formula: C22H26BrN3O3S MolecularWeight: 492.42914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC(=CC=C2)N(C)C(=O)C

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC(=CC=C2)N(C)C(=O)C

InChI

InChI=1S/C22H26BrN3O3S/c1-14(2)10-11-29-20-9-8-16(23)12-19(20)21(28)25-22(30)24-17-6-5-7-18(13-17)26(4)15(3)27/h5-9,12-14H,10-11H2,1-4H3,(H2,24,25,28,30)