1-[bis(azanyl)methylidene]-3-propyl-thiourea; 4-methylbenzenesulfonic acid

Systemtic Name: 1-[bis(azanyl)methylidene]-3-propyl-thiourea; 4-methylbenzenesulfonic acid Openeye Name: 1-(diaminomethylene)-3-propyl-thiourea; 4-methylbenzenesulfonic acid CAS Name: 1-(diaminomethylidene)-3-propylthiourea; 4-methylbenzenesulfonic acid IUPAC Name: 1-(diaminomethylidene)-3-propylthiourea; 4-methylbenzenesulfonic acid Traditional Name: 1-(diaminomethylene)-3-propyl-thiourea; tosylic acid Formula: C12H20N4O3S2 MolecularWeight: 332.4422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8O3S.C5H12N4S/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-3-8-5(10)9-4(6)7/h2-5H,1H3,(H,8,9,10);2-3H2,1H3,(H5,6,7,8,9,10)