N,N-diethyl-3-[(4-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3S/c1-5-25(6-2)21(27)17-8-7-9-18(14-17)23-22(29)24-20(26)16-10-12-19(13-11-16)28-15(3)4/h7-15H,5-6H2,1-4H3,(H2,23,24,26,29)