6-butyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-benzothiazol-2-amine

Systemtic Name: 6-butyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-benzothiazol-2-amine Openeye Name: 6-butyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-benzothiazol-2-amine CAS Name: 6-butyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-benzothiazol-2-amine IUPAC Name: 6-butyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,3-benzothiazol-2-amine Traditional Name: (6-butyl-1,3-benzothiazol-2-yl)-(6-mesyl-1,3-benzothiazol-2-yl)amine Formula: C19H19N3O2S3 MolecularWeight: 417.56806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C19H19N3O2S3/c1-3-4-5-12-6-8-14-16(10-12)25-18(20-14)22-19-21-15-9-7-13(27(2,23)24)11-17(15)26-19/h6-11H,3-5H2,1-2H3,(H,20,21,22)