N-(2-adamantylideneamino)-4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-(2-adamantylideneamino)-4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzamide Openeye Name: N-(2-adamantylideneamino)-4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzamide CAS Name: N-(2-adamantylideneamino)-4-[(1,3-benzothiazol-2-ylthio)methyl]benzamide IUPAC Name: N-(2-adamantylideneamino)-4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzamide Traditional Name: N-(2-adamantylideneamino)-4-[(1,3-benzothiazol-2-ylthio)methyl]benzamide Formula: C25H25N3OS2 MolecularWeight: 447.6155

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3=NNC(=O)C4=CC=C(C=C4)CSC5=NC6=CC=CC=C6S5

Isomeric SMILES

C1C2CC3CC1CC(C2)C3=NNC(=O)C4=CC=C(C=C4)CSC5=NC6=CC=CC=C6S5

InChI

InChI=1S/C25H25N3OS2/c29-24(28-27-23-19-10-16-9-17(12-19)13-20(23)11-16)18-7-5-15(6-8-18)14-30-25-26-21-3-1-2-4-22(21)31-25/h1-8,16-17,19-20H,9-14H2,(H,28,29)