1-[bis(azanyl)methylidene]-3-(4-chloranyl-3-methyl-phenyl)urea; ethanesulfonic acid

Systemtic Name: 1-[bis(azanyl)methylidene]-3-(4-chloranyl-3-methyl-phenyl)urea; ethanesulfonic acid Openeye Name: 1-(4-chloro-3-methyl-phenyl)-3-(diaminomethylene)urea; ethanesulfonic acid CAS Name: 1-(4-chloro-3-methylphenyl)-3-(diaminomethylidene)urea; ethanesulfonic acid IUPAC Name: 1-(4-chloro-3-methylphenyl)-3-(diaminomethylidene)urea; ethanesulfonic acid Traditional Name: 1-(4-chloro-3-methyl-phenyl)-3-(diaminomethylene)urea; esylic acid Formula: C11H17ClN4O4S MolecularWeight: 336.79508

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)O.CC1=C(C=CC(=C1)NC(=O)N=C(N)N)Cl

Isomeric SMILES

CCS(=O)(=O)O.CC1=C(C=CC(=C1)NC(=O)N=C(N)N)Cl

InChI

InChI=1S/C9H11ClN4O.C2H6O3S/c1-5-4-6(2-3-7(5)10)13-9(15)14-8(11)12;1-2-6(3,4)5/h2-4H,1H3,(H5,11,12,13,14,15);2H2,1H3,(H,3,4,5)