2-azanyl-4-(3-iodanylphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbothioamide

Systemtic Name: 2-azanyl-4-(3-iodanylphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbothioamide Openeye Name: 2-amino-4-(3-iodophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbothioamide CAS Name: 2-amino-4-(3-iodophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbothioamide IUPAC Name: 2-amino-4-(3-iodophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbothioamide Traditional Name: 2-amino-4-(3-iodophenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbothioamide Formula: C18H19IN2O2S MolecularWeight: 454.32513

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C(=S)N)C3=CC(=CC=C3)I)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C(=S)N)C3=CC(=CC=C3)I)C(=O)C1)C

InChI

InChI=1S/C18H19IN2O2S/c1-18(2)7-11(22)14-12(8-18)23-16(20)15(17(21)24)13(14)9-4-3-5-10(19)6-9/h3-6,13H,7-8,20H2,1-2H3,(H2,21,24)