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

Systemtic Name: N-[bis(azanyl)methylidene]-4-[(3-cyanophenyl)-methyl-amino]-2-methyl-5-methylsulfonyl-benzamide Openeye Name: 4-(3-cyano-N-methyl-anilino)-N-(diaminomethylene)-2-methyl-5-methylsulfonyl-benzamide CAS Name: 4-(3-cyano-N-methylanilino)-N-(diaminomethylidene)-2-methyl-5-methylsulfonylbenzamide IUPAC Name: 4-(3-cyano-N-methylanilino)-N-(diaminomethylidene)-2-methyl-5-methylsulfonylbenzamide Traditional Name: 4-(3-cyano-N-methyl-anilino)-N-(diaminomethylene)-5-mesyl-2-methyl-benzamide Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)N(C)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N=C(N)N)S(=O)(=O)C)N(C)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C18H19N5O3S/c1-11-7-15(23(2)13-6-4-5-12(8-13)10-19)16(27(3,25)26)9-14(11)17(24)22-18(20)21/h4-9H,1-3H3,(H4,20,21,22,24)