1-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-prop-2-enyl-guanidine hydrochloride

Systemtic Name: 1-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-prop-2-enyl-guanidine hydrochloride Openeye Name: 2-allyl-1-[5-(o-tolyl)-1,3,4-thiadiazol-2-yl]guanidine hydrochloride CAS Name: 1-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-prop-2-enylguanidine hydrochloride IUPAC Name: 1-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-prop-2-enylguanidine hydrochloride Traditional Name: 2-allyl-1-[5-(o-tolyl)-1,3,4-thiadiazol-2-yl]guanidine hydrochloride Formula: C13H16ClN5S MolecularWeight: 309.81764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(S2)NC(=NCC=C)N.Cl

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(S2)NC(=NCC=C)N.Cl

InChI

InChI=1S/C13H15N5S.ClH/c1-3-8-15-12(14)16-13-18-17-11(19-13)10-7-5-4-6-9(10)2;/h3-7H,1,8H2,2H3,(H3,14,15,16,18);1H