3-bromanyl-N-[[3-[ethanoyl(methyl)amino]phenyl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[3-[ethanoyl(methyl)amino]phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[3-[acetyl(methyl)amino]phenyl]carbamothioyl]-3-bromo-4-propoxy-benzamide CAS Name: N-[[3-[acetyl(methyl)amino]anilino]-sulfanylidenemethyl]-3-bromo-4-propoxybenzamide IUPAC Name: N-[[3-[acetyl(methyl)amino]phenyl]carbamothioyl]-3-bromo-4-propoxybenzamide Traditional Name: N-[[3-[acetyl(methyl)amino]phenyl]thiocarbamoyl]-3-bromo-4-propoxy-benzamide Formula: C20H22BrN3O3S MolecularWeight: 464.37598

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)N(C)C(=O)C)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)N(C)C(=O)C)Br

InChI

InChI=1S/C20H22BrN3O3S/c1-4-10-27-18-9-8-14(11-17(18)21)19(26)23-20(28)22-15-6-5-7-16(12-15)24(3)13(2)25/h5-9,11-12H,4,10H2,1-3H3,(H2,22,23,26,28)