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

Systemtic Name: N-[bis(azanyl)methylidene]-4-[(2-chlorophenyl)-methyl-amino]-2-ethyl-5-methylsulfonyl-benzamide Openeye Name: 4-(2-chloro-N-methyl-anilino)-N-(diaminomethylene)-2-ethyl-5-methylsulfonyl-benzamide CAS Name: 4-(2-chloro-N-methylanilino)-N-(diaminomethylidene)-2-ethyl-5-methylsulfonylbenzamide IUPAC Name: 4-(2-chloro-N-methylanilino)-N-(diaminomethylidene)-2-ethyl-5-methylsulfonylbenzamide Traditional Name: 4-(2-chloro-N-methyl-anilino)-N-(diaminomethylene)-2-ethyl-5-mesyl-benzamide Formula: C18H21ClN4O3S MolecularWeight: 408.90234

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)N(C)C2=CC=CC=C2Cl

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)N(C)C2=CC=CC=C2Cl

InChI

InChI=1S/C18H21ClN4O3S/c1-4-11-9-15(23(2)14-8-6-5-7-13(14)19)16(27(3,25)26)10-12(11)17(24)22-18(20)21/h5-10H,4H2,1-3H3,(H4,20,21,22,24)