N-[[(4-benzamidophenyl)carbonylamino]carbamothioyl]-5-bromanyl-2-phenethyloxy-benzamide

Systemtic Name: N-[[(4-benzamidophenyl)carbonylamino]carbamothioyl]-5-bromanyl-2-phenethyloxy-benzamide Openeye Name: N-[[(4-benzamidobenzoyl)amino]carbamothioyl]-5-bromo-2-phenethyloxy-benzamide CAS Name: N-[[[(4-benzamidophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-5-bromo-2-phenethyloxybenzamide IUPAC Name: N-[[(4-benzamidobenzoyl)amino]carbamothioyl]-5-bromo-2-phenethyloxybenzamide Traditional Name: N-[[(4-benzamidobenzoyl)amino]thiocarbamoyl]-5-bromo-2-phenethyloxy-benzamide Formula: C30H25BrN4O4S MolecularWeight: 617.5129

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)NC(=S)NNC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)NC(=S)NNC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H25BrN4O4S/c31-23-13-16-26(39-18-17-20-7-3-1-4-8-20)25(19-23)29(38)33-30(40)35-34-28(37)22-11-14-24(15-12-22)32-27(36)21-9-5-2-6-10-21/h1-16,19H,17-18H2,(H,32,36)(H,34,37)(H2,33,35,38,40)