N-tert-butyl-2-(pentanoylcarbamothioylamino)benzamide

Systemtic Name: N-tert-butyl-2-(pentanoylcarbamothioylamino)benzamide Openeye Name: N-tert-butyl-2-(pentanoylcarbamothioylamino)benzamide CAS Name: N-tert-butyl-2-[[(1-oxopentylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-tert-butyl-2-(pentanoylcarbamothioylamino)benzamide Traditional Name: N-tert-butyl-2-(valerylthiocarbamoylamino)benzamide Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)NC(C)(C)C

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)NC(C)(C)C

InChI

InChI=1S/C17H25N3O2S/c1-5-6-11-14(21)19-16(23)18-13-10-8-7-9-12(13)15(22)20-17(2,3)4/h7-10H,5-6,11H2,1-4H3,(H,20,22)(H2,18,19,21,23)