N5-(3-iodanylphenyl)-2-methyl-1,3-benzothiazole-5,6-diamine

Systemtic Name: N5-(3-iodanylphenyl)-2-methyl-1,3-benzothiazole-5,6-diamine Openeye Name: N5-(3-iodophenyl)-2-methyl-1,3-benzothiazole-5,6-diamine CAS Name: N5-(3-iodophenyl)-2-methyl-1,3-benzothiazole-5,6-diamine IUPAC Name: 5-N-(3-iodophenyl)-2-methyl-1,3-benzothiazole-5,6-diamine Traditional Name: (6-amino-2-methyl-1,3-benzothiazol-5-yl)-(3-iodophenyl)amine Formula: C14H12IN3S MolecularWeight: 381.23465

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=C(C=C2S1)N)NC3=CC(=CC=C3)I

Isomeric SMILES

CC1=NC2=CC(=C(C=C2S1)N)NC3=CC(=CC=C3)I

InChI

InChI=1S/C14H12IN3S/c1-8-17-13-7-12(11(16)6-14(13)19-8)18-10-4-2-3-9(15)5-10/h2-7,18H,16H2,1H3