N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C23H25N5OS MolecularWeight: 419.5425

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NC(=O)C5=CC=C(C=C5)CN6C=NC=N6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NC(=O)C5=CC=C(C=C5)CN6C=NC=N6

InChI

InChI=1S/C23H25N5OS/c29-21(19-3-1-15(2-4-19)11-28-14-24-13-25-28)27-22-26-20(12-30-22)23-8-16-5-17(9-23)7-18(6-16)10-23/h1-4,12-14,16-18H,5-11H2,(H,26,27,29)