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

Systemtic Name: N-[(cyclopropylcarbonylamino)carbamothioyl]-3-iodanyl-4-methoxy-benzamide Openeye Name: N-[(cyclopropanecarbonylamino)carbamothioyl]-3-iodo-4-methoxy-benzamide CAS Name: N-[[[cyclopropyl(oxo)methyl]hydrazo]-sulfanylidenemethyl]-3-iodo-4-methoxybenzamide IUPAC Name: N-[(cyclopropanecarbonylamino)carbamothioyl]-3-iodo-4-methoxybenzamide Traditional Name: N-[(cyclopropanecarbonylamino)thiocarbamoyl]-3-iodo-4-methoxy-benzamide Formula: C13H14IN3O3S MolecularWeight: 419.23803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2CC2)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2CC2)I

InChI

InChI=1S/C13H14IN3O3S/c1-20-10-5-4-8(6-9(10)14)11(18)15-13(21)17-16-12(19)7-2-3-7/h4-7H,2-3H2,1H3,(H,16,19)(H2,15,17,18,21)