5-bromanyl-2-hexoxy-N-[[2-[(4-phenylazanylphenyl)carbamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-hexoxy-N-[[2-[(4-phenylazanylphenyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: N-[[2-[(4-anilinophenyl)carbamoyl]phenyl]carbamothioyl]-5-bromo-2-hexoxy-benzamide CAS Name: N-[[2-[(4-anilinoanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-5-bromo-2-hexoxybenzamide IUPAC Name: N-[[2-[(4-anilinophenyl)carbamoyl]phenyl]carbamothioyl]-5-bromo-2-hexoxybenzamide Traditional Name: N-[[2-[(4-anilinophenyl)carbamoyl]phenyl]thiocarbamoyl]-5-bromo-2-hexoxy-benzamide Formula: C33H33BrN4O3S MolecularWeight: 645.60912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)NC4=CC=CC=C4

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)NC4=CC=CC=C4

InChI

InChI=1S/C33H33BrN4O3S/c1-2-3-4-10-21-41-30-20-15-23(34)22-28(30)32(40)38-33(42)37-29-14-9-8-13-27(29)31(39)36-26-18-16-25(17-19-26)35-24-11-6-5-7-12-24/h5-9,11-20,22,35H,2-4,10,21H2,1H3,(H,36,39)(H2,37,38,40,42)