N-[2-methyl-5-(3-methylbutanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide

Systemtic Name: N-[2-methyl-5-(3-methylbutanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide Openeye Name: N-[2-methyl-5-(3-methylbutanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide CAS Name: N-[2-methyl-5-[[[(3-methyl-1-oxobutyl)amino]-sulfanylidenemethyl]amino]phenyl]cyclopropanecarboxamide IUPAC Name: N-[2-methyl-5-(3-methylbutanoylcarbamothioylamino)phenyl]cyclopropanecarboxamide Traditional Name: N-[5-(isovalerylthiocarbamoylamino)-2-methyl-phenyl]cyclopropanecarboxamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC(=O)CC(C)C)NC(=O)C2CC2

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC(=O)CC(C)C)NC(=O)C2CC2

InChI

InChI=1S/C17H23N3O2S/c1-10(2)8-15(21)20-17(23)18-13-7-4-11(3)14(9-13)19-16(22)12-5-6-12/h4,7,9-10,12H,5-6,8H2,1-3H3,(H,19,22)(H2,18,20,21,23)