2-[[(Z)-2H-isoquinolin-1-ylidenemethyl]amino]-1-oxidanylidene-guanidine; 4-methylbenzenesulfonic acid

Systemtic Name: 2-[[(Z)-2H-isoquinolin-1-ylidenemethyl]amino]-1-oxidanylidene-guanidine; 4-methylbenzenesulfonic acid Openeye Name: 2-[[(Z)-2H-isoquinolin-1-ylidenemethyl]amino]-1-oxo-guanidine; 4-methylbenzenesulfonic acid CAS Name: 2-[[(Z)-2H-isoquinolin-1-ylidenemethyl]amino]-1-oxoguanidine; 4-methylbenzenesulfonic acid IUPAC Name: 2-[[(Z)-2H-isoquinolin-1-ylidenemethyl]amino]-1-oxoguanidine; 4-methylbenzenesulfonic acid Traditional Name: 2-[[(Z)-2H-isoquinolin-1-ylidenemethyl]amino]-1-keto-guanidine; tosylic acid Formula: C18H19N5O4S MolecularWeight: 401.43956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C2C(=C1)C=CNC2=CNN=C(N)N=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C\2C(=C1)C=CN/C2=C\N/N=C(\N)/N=O

InChI

InChI=1S/C11H11N5O.C7H8O3S/c12-11(16-17)15-14-7-10-9-4-2-1-3-8(9)5-6-13-10;1-6-2-4-7(5-3-6)11(8,9)10/h1-7,13-14H,(H2,12,15);2-5H,1H3,(H,8,9,10)/b10-7-;