2-(1-adamantyl)-N-(6-sulfanyl-1,3-benzothiazol-2-yl)ethanimidate

Systemtic Name: 2-(1-adamantyl)-N-(6-sulfanyl-1,3-benzothiazol-2-yl)ethanimidate Openeye Name: 2-(1-adamantyl)-N-(6-sulfanyl-1,3-benzothiazol-2-yl)ethanimidate CAS Name: 2-(1-adamantyl)-N-(6-mercapto-1,3-benzothiazol-2-yl)ethanimidate IUPAC Name: 2-(1-adamantyl)-N-(6-sulfanyl-1,3-benzothiazol-2-yl)ethanimidate Traditional Name: 2-(1-adamantyl)-N-(6-mercapto-1,3-benzothiazol-2-yl)acetimidate Formula: C19H21N2OS2- MolecularWeight: 357.51284

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=NC4=NC5=C(S4)C=C(C=C5)S)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=NC4=NC5=C(S4)C=C(C=C5)S)[O-]

InChI

InChI=1S/C19H22N2OS2/c22-17(21-18-20-15-2-1-14(23)6-16(15)24-18)10-19-7-11-3-12(8-19)5-13(4-11)9-19/h1-2,6,11-13,23H,3-5,7-10H2,(H,20,21,22)/p-1