4-[4-(1-adamantyl)-1,3-thiazol-2-yl]benzaldehyde

Systemtic Name: 4-[4-(1-adamantyl)-1,3-thiazol-2-yl]benzaldehyde Openeye Name: 4-[4-(1-adamantyl)thiazol-2-yl]benzaldehyde CAS Name: 4-[4-(1-adamantyl)-2-thiazolyl]benzaldehyde IUPAC Name: 4-[4-(1-adamantyl)-1,3-thiazol-2-yl]benzaldehyde Traditional Name: 4-[4-(1-adamantyl)thiazol-2-yl]benzaldehyde Formula: C20H21NOS MolecularWeight: 323.45184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NOS/c22-11-13-1-3-17(4-2-13)19-21-18(12-23-19)20-8-14-5-15(9-20)7-16(6-14)10-20/h1-4,11-12,14-16H,5-10H2