N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-4-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-4-(2-phenoxyethoxy)benzamide Openeye Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-4-(2-phenoxyethoxy)benzamide CAS Name: N-[[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-(2-phenoxyethoxy)benzamide IUPAC Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-4-(2-phenoxyethoxy)benzamide Traditional Name: N-[[(4-tert-butylbenzoyl)amino]thiocarbamoyl]-4-(2-phenoxyethoxy)benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O4S/c1-27(2,3)21-13-9-20(10-14-21)25(32)29-30-26(35)28-24(31)19-11-15-23(16-12-19)34-18-17-33-22-7-5-4-6-8-22/h4-16H,17-18H2,1-3H3,(H,29,32)(H2,28,30,31,35)