2-(1-adamantyl)-4-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole

Systemtic Name: 2-(1-adamantyl)-4-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Openeye Name: 2-(1-adamantyl)-4-[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole CAS Name: 2-(1-adamantyl)-4-[[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]methyl]thiazole IUPAC Name: 2-(1-adamantyl)-4-[(4-phenyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole Traditional Name: 2-(1-adamantyl)-4-[[[4-phenyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole Formula: C26H26N4S3 MolecularWeight: 490.70644

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NC(=CS4)CSC5=NN=C(N5C6=CC=CC=C6)C7=CC=CS7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NC(=CS4)CSC5=NN=C(N5C6=CC=CC=C6)C7=CC=CS7

InChI

InChI=1S/C26H26N4S3/c1-2-5-21(6-3-1)30-23(22-7-4-8-31-22)28-29-25(30)33-16-20-15-32-24(27-20)26-12-17-9-18(13-26)11-19(10-17)14-26/h1-8,15,17-19H,9-14,16H2