4-tert-butyl-N-[4-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[4-[2-(4-methoxyphenyl)ethanoylcarbamothioylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[4-[[[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-[[2-(4-methoxyphenyl)acetyl]carbamothioylamino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-[[2-(4-methoxyphenyl)acetyl]thiocarbamoylamino]phenyl]benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)CC3=CC=C(C=C3)OC

InChI

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