N5-(3-methylbutyl)-1,3-benzothiazole-4,5-diamine

Systemtic Name: N5-(3-methylbutyl)-1,3-benzothiazole-4,5-diamine Openeye Name: N5-isopentyl-1,3-benzothiazole-4,5-diamine CAS Name: N5-(3-methylbutyl)-1,3-benzothiazole-4,5-diamine IUPAC Name: 5-N-(3-methylbutyl)-1,3-benzothiazole-4,5-diamine Traditional Name: (4-amino-1,3-benzothiazol-5-yl)-isoamyl-amine Formula: C12H17N3S MolecularWeight: 235.34848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=C(C2=C(C=C1)SC=N2)N

Isomeric SMILES

CC(C)CCNC1=C(C2=C(C=C1)SC=N2)N

InChI

InChI=1S/C12H17N3S/c1-8(2)5-6-14-9-3-4-10-12(11(9)13)15-7-16-10/h3-4,7-8,14H,5-6,13H2,1-2H3