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

Systemtic Name: N-[bis(azanyl)methylidene]-4-(2,4-dimethylphenyl)sulfanyl-2-methyl-5-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-4-(2,4-dimethylphenyl)sulfanyl-2-methyl-5-methylsulfonyl-benzamide CAS Name: N-(diaminomethylidene)-4-[(2,4-dimethylphenyl)thio]-2-methyl-5-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-4-(2,4-dimethylphenyl)sulfanyl-2-methyl-5-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-4-[(2,4-dimethylphenyl)thio]-5-mesyl-2-methyl-benzamide Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2=C(C=C(C(=C2)C)C(=O)N=C(N)N)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)SC2=C(C=C(C(=C2)C)C(=O)N=C(N)N)S(=O)(=O)C)C

InChI

InChI=1S/C18H21N3O3S2/c1-10-5-6-14(12(3)7-10)25-15-8-11(2)13(17(22)21-18(19)20)9-16(15)26(4,23)24/h5-9H,1-4H3,(H4,19,20,21,22)