1-[bis(azanyl)methylidene]-2-(phenylmethyl)guanidine; 4-methylbenzenesulfonic acid

Systemtic Name: 1-[bis(azanyl)methylidene]-2-(phenylmethyl)guanidine; 4-methylbenzenesulfonic acid Openeye Name: 2-benzyl-1-(diaminomethylene)guanidine; 4-methylbenzenesulfonic acid CAS Name: 1-(diaminomethylidene)-2-(phenylmethyl)guanidine; 4-methylbenzenesulfonic acid IUPAC Name: 2-benzyl-1-(diaminomethylidene)guanidine; 4-methylbenzenesulfonic acid Traditional Name: 2-benzyl-1-(diaminomethylene)guanidine; tosylic acid Formula: C16H21N5O3S MolecularWeight: 363.43464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)CN=C(N)N=C(N)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)CN=C(N)N=C(N)N

InChI

InChI=1S/C9H13N5.C7H8O3S/c10-8(11)14-9(12)13-6-7-4-2-1-3-5-7;1-6-2-4-7(5-3-6)11(8,9)10/h1-5H,6H2,(H6,10,11,12,13,14);2-5H,1H3,(H,8,9,10)