4-(pentanoylcarbamothioylamino)-N-propyl-benzamide

Systemtic Name: 4-(pentanoylcarbamothioylamino)-N-propyl-benzamide Openeye Name: 4-(pentanoylcarbamothioylamino)-N-propyl-benzamide CAS Name: 4-[[(1-oxopentylamino)-sulfanylidenemethyl]amino]-N-propylbenzamide IUPAC Name: 4-(pentanoylcarbamothioylamino)-N-propylbenzamide Traditional Name: N-propyl-4-(valerylthiocarbamoylamino)benzamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)NCCC

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)NCCC

InChI

InChI=1S/C16H23N3O2S/c1-3-5-6-14(20)19-16(22)18-13-9-7-12(8-10-13)15(21)17-11-4-2/h7-10H,3-6,11H2,1-2H3,(H,17,21)(H2,18,19,20,22)