1-[bis(azanyl)methylideneamino]-3-butyl-thiourea; 4-methylbenzenesulfonic acid

Systemtic Name: 1-[bis(azanyl)methylideneamino]-3-butyl-thiourea; 4-methylbenzenesulfonic acid Openeye Name: 1-butyl-3-guanidino-thiourea; 4-methylbenzenesulfonic acid CAS Name: 1-butyl-3-(diaminomethylideneamino)thiourea; 4-methylbenzenesulfonic acid IUPAC Name: 1-butyl-3-(diaminomethylideneamino)thiourea; 4-methylbenzenesulfonic acid Traditional Name: 1-butyl-3-guanidino-thiourea; tosylic acid Formula: C13H23N5O3S2 MolecularWeight: 361.48342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=C(N)N.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCCCNC(=S)NN=C(N)N.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C7H8O3S.C6H15N5S/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-3-4-9-6(12)11-10-5(7)8/h2-5H,1H3,(H,8,9,10);2-4H2,1H3,(H4,7,8,10)(H2,9,11,12)