2-[(3-butan-2-yloxyphenyl)carbonylcarbamothioylamino]-N-prop-2-enyl-benzamide

Systemtic Name: 2-[(3-butan-2-yloxyphenyl)carbonylcarbamothioylamino]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-2-[(3-sec-butoxybenzoyl)carbamothioylamino]benzamide CAS Name: 2-[[[[(3-butan-2-yloxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-prop-2-enylbenzamide IUPAC Name: 2-[(3-butan-2-yloxybenzoyl)carbamothioylamino]-N-prop-2-enylbenzamide Traditional Name: N-allyl-2-[(3-sec-butoxybenzoyl)thiocarbamoylamino]benzamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC=C

Isomeric SMILES

CCC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC=C

InChI

InChI=1S/C22H25N3O3S/c1-4-13-23-21(27)18-11-6-7-12-19(18)24-22(29)25-20(26)16-9-8-10-17(14-16)28-15(3)5-2/h4,6-12,14-15H,1,5,13H2,2-3H3,(H,23,27)(H2,24,25,26,29)