N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]-4-phenyl-benzamide

Systemtic Name: N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]-4-phenyl-benzamide Openeye Name: N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-4-phenyl-benzamide CAS Name: N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-4-phenylbenzamide Traditional Name: N-[[(4-hexoxybenzoyl)amino]thiocarbamoyl]-4-phenyl-benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-2-3-4-8-19-33-24-17-15-23(16-18-24)26(32)29-30-27(34)28-25(31)22-13-11-21(12-14-22)20-9-6-5-7-10-20/h5-7,9-18H,2-4,8,19H2,1H3,(H,29,32)(H2,28,30,31,34)