N-tert-butyl-3-[(3-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-tert-butyl-3-[(3-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-tert-butyl-3-[(3-isopropoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-tert-butyl-3-[[[[oxo-(3-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-tert-butyl-3-[(3-propan-2-yloxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-tert-butyl-3-[(3-isopropoxybenzoyl)thiocarbamoylamino]benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)(C)C

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)(C)C

InChI

InChI=1S/C22H27N3O3S/c1-14(2)28-18-11-7-9-16(13-18)19(26)24-21(29)23-17-10-6-8-15(12-17)20(27)25-22(3,4)5/h6-14H,1-5H3,(H,25,27)(H2,23,24,26,29)