5-(4-imidazol-1-ylbutyl)-4-(phenoxymethyl)-2-thiophen-2-yl-1,3-benzoxazole

Systemtic Name: 5-(4-imidazol-1-ylbutyl)-4-(phenoxymethyl)-2-thiophen-2-yl-1,3-benzoxazole Openeye Name: 5-(4-imidazol-1-ylbutyl)-4-(phenoxymethyl)-2-(2-thienyl)-1,3-benzoxazole CAS Name: 5-[4-(1-imidazolyl)butyl]-4-(phenoxymethyl)-2-thiophen-2-yl-1,3-benzoxazole IUPAC Name: 5-(4-imidazol-1-ylbutyl)-4-(phenoxymethyl)-2-thiophen-2-yl-1,3-benzoxazole Traditional Name: 5-(4-imidazol-1-ylbutyl)-4-(phenoxymethyl)-2-(2-thienyl)-1,3-benzoxazole Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=C(C=CC3=C2N=C(O3)C4=CC=CS4)CCCCN5C=CN=C5

Isomeric SMILES

C1=CC=C(C=C1)OCC2=C(C=CC3=C2N=C(O3)C4=CC=CS4)CCCCN5C=CN=C5

InChI

InChI=1S/C25H23N3O2S/c1-2-8-20(9-3-1)29-17-21-19(7-4-5-14-28-15-13-26-18-28)11-12-22-24(21)27-25(30-22)23-10-6-16-31-23/h1-3,6,8-13,15-16,18H,4-5,7,14,17H2