4-tert-butyl-N-[4-[(4-propoxyphenyl)carbonylcarbamothioylamino]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[4-[(4-propoxyphenyl)carbonylcarbamothioylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-[(4-propoxybenzoyl)carbamothioylamino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[4-[[[[oxo-(4-propoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-[(4-propoxybenzoyl)carbamothioylamino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-[(4-propoxybenzoyl)thiocarbamoylamino]phenyl]benzamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C28H31N3O3S/c1-5-18-34-24-16-8-20(9-17-24)26(33)31-27(35)30-23-14-12-22(13-15-23)29-25(32)19-6-10-21(11-7-19)28(2,3)4/h6-17H,5,18H2,1-4H3,(H,29,32)(H2,30,31,33,35)