N-heptyl-2-methylsulfanyl-1,3-benzothiazol-6-amine

Systemtic Name: N-heptyl-2-methylsulfanyl-1,3-benzothiazol-6-amine Openeye Name: N-heptyl-2-methylsulfanyl-1,3-benzothiazol-6-amine CAS Name: N-heptyl-2-(methylthio)-1,3-benzothiazol-6-amine IUPAC Name: N-heptyl-2-methylsulfanyl-1,3-benzothiazol-6-amine Traditional Name: heptyl-[2-(methylthio)-1,3-benzothiazol-6-yl]amine Formula: C15H22N2S2 MolecularWeight: 294.47858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC1=CC2=C(C=C1)N=C(S2)SC

Isomeric SMILES

CCCCCCCNC1=CC2=C(C=C1)N=C(S2)SC

InChI

InChI=1S/C15H22N2S2/c1-3-4-5-6-7-10-16-12-8-9-13-14(11-12)19-15(17-13)18-2/h8-9,11,16H,3-7,10H2,1-2H3