N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide Openeye Name: N-[(4-iodo-2-methyl-phenyl)carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide CAS Name: N-[(4-iodo-2-methylanilino)-sulfanylidenemethyl]-5-(2-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[(4-iodo-2-methylphenyl)carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide Traditional Name: N-[(4-iodo-2-methyl-phenyl)thiocarbamoyl]-5-(2-nitrophenyl)-2-furamide Formula: C19H14IN3O4S MolecularWeight: 507.30163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H14IN3O4S/c1-11-10-12(20)6-7-14(11)21-19(28)22-18(24)17-9-8-16(27-17)13-4-2-3-5-15(13)23(25)26/h2-10H,1H3,(H2,21,22,24,28)