N-[2-methyl-3-(pentanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide

Systemtic Name: N-[2-methyl-3-(pentanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide Openeye Name: N-[2-methyl-3-(pentanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide CAS Name: N-[2-methyl-3-[[(1-oxopentylamino)-sulfanylidenemethyl]amino]phenyl]cyclopropanecarboxamide IUPAC Name: N-[2-methyl-3-(pentanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide Traditional Name: N-[2-methyl-3-(valerylthiocarbamoylamino)phenyl]cyclopropanecarboxamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=CC(=C1C)NC(=O)C2CC2

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=CC(=C1C)NC(=O)C2CC2

InChI

InChI=1S/C17H23N3O2S/c1-3-4-8-15(21)20-17(23)19-14-7-5-6-13(11(14)2)18-16(22)12-9-10-12/h5-7,12H,3-4,8-10H2,1-2H3,(H,18,22)(H2,19,20,21,23)