N-[(cyclopropylcarbonylamino)carbamothioyl]-3-iodanyl-4-methyl-benzamide

Systemtic Name: N-[(cyclopropylcarbonylamino)carbamothioyl]-3-iodanyl-4-methyl-benzamide Openeye Name: N-[(cyclopropanecarbonylamino)carbamothioyl]-3-iodo-4-methyl-benzamide CAS Name: N-[[[cyclopropyl(oxo)methyl]hydrazo]-sulfanylidenemethyl]-3-iodo-4-methylbenzamide IUPAC Name: N-[(cyclopropanecarbonylamino)carbamothioyl]-3-iodo-4-methylbenzamide Traditional Name: N-[(cyclopropanecarbonylamino)thiocarbamoyl]-3-iodo-4-methyl-benzamide Formula: C13H14IN3O2S MolecularWeight: 403.23863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2CC2)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2CC2)I

InChI

InChI=1S/C13H14IN3O2S/c1-7-2-3-9(6-10(7)14)11(18)15-13(20)17-16-12(19)8-4-5-8/h2-3,6,8H,4-5H2,1H3,(H,16,19)(H2,15,17,18,20)