3-bromanyl-4-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-methyl-N-[(4-morpholinosulfonylphenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-methyl-N-[[4-(4-morpholinylsulfonyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-methyl-N-[(4-morpholinosulfonylphenyl)thiocarbamoyl]benzamide Formula: C19H20BrN3O4S2 MolecularWeight: 498.4138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)Br

InChI

InChI=1S/C19H20BrN3O4S2/c1-13-2-3-14(12-17(13)20)18(24)22-19(28)21-15-4-6-16(7-5-15)29(25,26)23-8-10-27-11-9-23/h2-7,12H,8-11H2,1H3,(H2,21,22,24,28)