N'-(2-adamantylmethyl)-2-[2-(2-adamantylmethylimino)-2-azanyl-ethyl]sulfanyl-ethanimidamide

Systemtic Name: N'-(2-adamantylmethyl)-2-[2-(2-adamantylmethylimino)-2-azanyl-ethyl]sulfanyl-ethanimidamide Openeye Name: N'-(2-adamantylmethyl)-2-[2-(2-adamantylmethylimino)-2-amino-ethyl]sulfanyl-acetamidine CAS Name: N'-(2-adamantylmethyl)-2-[[2-(2-adamantylmethylimino)-2-aminoethyl]thio]ethanimidamide IUPAC Name: N'-(2-adamantylmethyl)-2-[2-(2-adamantylmethylimino)-2-aminoethyl]sulfanylethanimidamide Traditional Name: N'-(2-adamantylmethyl)-2-[[2-(2-adamantylmethylimino)-2-amino-ethyl]thio]acetamidine Formula: C26H42N4S MolecularWeight: 442.70348

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3CN=C(CSCC(=NCC4C5CC6CC(C5)CC4C6)N)N

Isomeric SMILES

C1C2CC3CC1CC(C2)C3CN=C(CSCC(=NCC4C5CC6CC(C5)CC4C6)N)N

InChI

InChI=1S/C26H42N4S/c27-25(29-11-23-19-3-15-1-16(5-19)6-20(23)4-15)13-31-14-26(28)30-12-24-21-7-17-2-18(9-21)10-22(24)8-17/h15-24H,1-14H2,(H2,27,29)(H2,28,30)