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butyl carbamimidothioate; 4-methylbenzenesulfonic acid

butyl carbamimidothioate; 4-methylbenzenesulfonic acid

Systemtic Name:butyl carbamimidothioate; 4-methylbenzenesulfonic acid
Openeye Name:2-butylisothiourea; 4-methylbenzenesulfonic acid
CAS Name:carbamimidothioic acid butyl ester; 4-methylbenzenesulfonic acid
IUPAC Name:butyl carbamimidothioate; 4-methylbenzenesulfonic acid
Traditional Name:2-butylisothiourea; tosylic acid
Formula: C12H20N2O3S2
MolecularWeight: 304.4288
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C7H8O3S.C5H12N2S/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-3-4-8-5(6)7/h2-5H,1H3,(H,8,9,10);2-4H2,1H3,(H3,6,7)


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