N-[bis(azanyl)methylidene]-4-(3-fluorophenyl)sulfanyl-2-methyl-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-(3-fluorophenyl)sulfanyl-2-methyl-5-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-4-(3-fluorophenyl)sulfanyl-2-methyl-5-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-4-[(3-fluorophenyl)thio]-2-methyl-5-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-4-(3-fluorophenyl)sulfanyl-2-methyl-5-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-4-[(3-fluorophenyl)thio]-5-mesyl-2-methyl-benzamide Formula: C16H16FN3O3S2 MolecularWeight: 381.444943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)SC2=CC=CC(=C2)F

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)SC2=CC=CC(=C2)F

InChI

InChI=1S/C16H16FN3O3S2/c1-9-6-13(24-11-5-3-4-10(17)7-11)14(25(2,22)23)8-12(9)15(21)20-16(18)19/h3-8H,1-2H3,(H4,18,19,20,21)