1-(1-adamantyl)-N,N'-bis(1,3-benzothiazol-2-yl)methanediamine

Systemtic Name: 1-(1-adamantyl)-N,N'-bis(1,3-benzothiazol-2-yl)methanediamine Openeye Name: 1-(1-adamantyl)-N,N'-bis(1,3-benzothiazol-2-yl)methanediamine CAS Name: 1-(1-adamantyl)-N,N'-bis(1,3-benzothiazol-2-yl)methanediamine IUPAC Name: 1-(1-adamantyl)-N,N'-bis(1,3-benzothiazol-2-yl)methanediamine Traditional Name: [1-adamantyl-(1,3-benzothiazol-2-ylamino)methyl]-(1,3-benzothiazol-2-yl)amine Formula: C25H26N4S2 MolecularWeight: 446.63074

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(NC4=NC5=CC=CC=C5S4)NC6=NC7=CC=CC=C7S6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(NC4=NC5=CC=CC=C5S4)NC6=NC7=CC=CC=C7S6

InChI

InChI=1S/C25H26N4S2/c1-3-7-20-18(5-1)26-23(30-20)28-22(29-24-27-19-6-2-4-8-21(19)31-24)25-12-15-9-16(13-25)11-17(10-15)14-25/h1-8,15-17,22H,9-14H2,(H,26,28)(H,27,29)