1-[bis(azanyl)methylidene]-3-(2-methylsulfonyl-6-propyl-phenyl)urea

Systemtic Name: 1-[bis(azanyl)methylidene]-3-(2-methylsulfonyl-6-propyl-phenyl)urea Openeye Name: 1-(diaminomethylene)-3-(2-methylsulfonyl-6-propyl-phenyl)urea CAS Name: 1-(diaminomethylidene)-3-(2-methylsulfonyl-6-propylphenyl)urea IUPAC Name: 1-(diaminomethylidene)-3-(2-methylsulfonyl-6-propylphenyl)urea Traditional Name: 1-(diaminomethylene)-3-(2-mesyl-6-propyl-phenyl)urea Formula: C12H18N4O3S MolecularWeight: 298.36132

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC=C1)S(=O)(=O)C)NC(=O)N=C(N)N

Isomeric SMILES

CCCC1=C(C(=CC=C1)S(=O)(=O)C)NC(=O)N=C(N)N

InChI

InChI=1S/C12H18N4O3S/c1-3-5-8-6-4-7-9(20(2,18)19)10(8)15-12(17)16-11(13)14/h4,6-7H,3,5H2,1-2H3,(H5,13,14,15,16,17)