N-butan-2-yl-3-[(4-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-butan-2-yl-3-[(4-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: 3-[(4-isopropoxybenzoyl)carbamothioylamino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-3-[[[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butan-2-yl-3-[(4-propan-2-yloxybenzoyl)carbamothioylamino]benzamide Traditional Name: 3-[(4-isopropoxybenzoyl)thiocarbamoylamino]-N-sec-butyl-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC(C)C

Isomeric SMILES

CCC(C)NC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC(C)C

InChI

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