2-[(4-butan-2-yloxyphenyl)carbonylcarbamothioylamino]-N-prop-2-enyl-benzamide

Systemtic Name: 2-[(4-butan-2-yloxyphenyl)carbonylcarbamothioylamino]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-2-[(4-sec-butoxybenzoyl)carbamothioylamino]benzamide CAS Name: 2-[[[[(4-butan-2-yloxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-prop-2-enylbenzamide IUPAC Name: 2-[(4-butan-2-yloxybenzoyl)carbamothioylamino]-N-prop-2-enylbenzamide Traditional Name: N-allyl-2-[(4-sec-butoxybenzoyl)thiocarbamoylamino]benzamide Formula: C22H25N3O3S MolecularWeight: 411.5172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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