N-[[(2-bromophenyl)carbonylamino]carbamothioyl]-4-heptoxy-benzamide

Systemtic Name: N-[[(2-bromophenyl)carbonylamino]carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[[(2-bromobenzoyl)amino]carbamothioyl]-4-heptoxy-benzamide CAS Name: N-[[[(2-bromophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[[(2-bromobenzoyl)amino]carbamothioyl]-4-heptoxybenzamide Traditional Name: N-[[(2-bromobenzoyl)amino]thiocarbamoyl]-4-heptoxy-benzamide Formula: C22H26BrN3O3S MolecularWeight: 492.42914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C22H26BrN3O3S/c1-2-3-4-5-8-15-29-17-13-11-16(12-14-17)20(27)24-22(30)26-25-21(28)18-9-6-7-10-19(18)23/h6-7,9-14H,2-5,8,15H2,1H3,(H,25,28)(H2,24,26,27,30)