N-[[3-(cyclopropylcarbonylamino)-4-methyl-phenyl]carbamothioyl]-2-iodanyl-benzamide

Systemtic Name: N-[[3-(cyclopropylcarbonylamino)-4-methyl-phenyl]carbamothioyl]-2-iodanyl-benzamide Openeye Name: N-[[3-(cyclopropanecarbonylamino)-4-methyl-phenyl]carbamothioyl]-2-iodo-benzamide CAS Name: N-[[3-[[cyclopropyl(oxo)methyl]amino]-4-methylanilino]-sulfanylidenemethyl]-2-iodobenzamide IUPAC Name: N-[[3-(cyclopropanecarbonylamino)-4-methylphenyl]carbamothioyl]-2-iodobenzamide Traditional Name: N-[[3-(cyclopropanecarbonylamino)-4-methyl-phenyl]thiocarbamoyl]-2-iodo-benzamide Formula: C19H18IN3O2S MolecularWeight: 479.33459

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2I)NC(=O)C3CC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2I)NC(=O)C3CC3

InChI

InChI=1S/C19H18IN3O2S/c1-11-6-9-13(10-16(11)22-17(24)12-7-8-12)21-19(26)23-18(25)14-4-2-3-5-15(14)20/h2-6,9-10,12H,7-8H2,1H3,(H,22,24)(H2,21,23,25,26)