3-[(4-tert-butylphenyl)carbonylcarbamothioylamino]-N-propyl-benzamide

Systemtic Name: 3-[(4-tert-butylphenyl)carbonylcarbamothioylamino]-N-propyl-benzamide Openeye Name: 3-[(4-tert-butylbenzoyl)carbamothioylamino]-N-propyl-benzamide CAS Name: 3-[[[[(4-tert-butylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-propylbenzamide IUPAC Name: 3-[(4-tert-butylbenzoyl)carbamothioylamino]-N-propylbenzamide Traditional Name: 3-[(4-tert-butylbenzoyl)thiocarbamoylamino]-N-propyl-benzamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCNC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H27N3O2S/c1-5-13-23-19(26)16-7-6-8-18(14-16)24-21(28)25-20(27)15-9-11-17(12-10-15)22(2,3)4/h6-12,14H,5,13H2,1-4H3,(H,23,26)(H2,24,25,27,28)