N-[bis(azanyl)methylidene]-4-(2-chlorophenyl)sulfanyl-2-ethyl-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-(2-chlorophenyl)sulfanyl-2-ethyl-5-methylsulfonyl-benzamide Openeye Name: 4-(2-chlorophenyl)sulfanyl-N-(diaminomethylene)-2-ethyl-5-methylsulfonyl-benzamide CAS Name: 4-[(2-chlorophenyl)thio]-N-(diaminomethylidene)-2-ethyl-5-methylsulfonylbenzamide IUPAC Name: 4-(2-chlorophenyl)sulfanyl-N-(diaminomethylidene)-2-ethyl-5-methylsulfonylbenzamide Traditional Name: 4-[(2-chlorophenyl)thio]-N-(diaminomethylene)-2-ethyl-5-mesyl-benzamide Formula: C17H18ClN3O3S2 MolecularWeight: 411.92612

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)SC2=CC=CC=C2Cl

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)SC2=CC=CC=C2Cl

InChI

InChI=1S/C17H18ClN3O3S2/c1-3-10-8-14(25-13-7-5-4-6-12(13)18)15(26(2,23)24)9-11(10)16(22)21-17(19)20/h4-9H,3H2,1-2H3,(H4,19,20,21,22)