N-[5-(hexanoylcarbamothioylamino)-2-methyl-phenyl]cyclopropanecarboxamide

Systemtic Name: N-[5-(hexanoylcarbamothioylamino)-2-methyl-phenyl]cyclopropanecarboxamide Openeye Name: N-[5-(hexanoylcarbamothioylamino)-2-methyl-phenyl]cyclopropanecarboxamide CAS Name: N-[2-methyl-5-[[(1-oxohexylamino)-sulfanylidenemethyl]amino]phenyl]cyclopropanecarboxamide IUPAC Name: N-[5-(hexanoylcarbamothioylamino)-2-methylphenyl]cyclopropanecarboxamide Traditional Name: N-[5-(caproylthiocarbamoylamino)-2-methyl-phenyl]cyclopropanecarboxamide Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC(=C(C=C1)C)NC(=O)C2CC2

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC(=C(C=C1)C)NC(=O)C2CC2

InChI

InChI=1S/C18H25N3O2S/c1-3-4-5-6-16(22)21-18(24)19-14-10-7-12(2)15(11-14)20-17(23)13-8-9-13/h7,10-11,13H,3-6,8-9H2,1-2H3,(H,20,23)(H2,19,21,22,24)