7-(2-methylbutyl)-2-[5-(2-methylbutyl)-3,4-diphenyl-thiophen-2-yl]-1,3-benzoxazole

Systemtic Name: 7-(2-methylbutyl)-2-[5-(2-methylbutyl)-3,4-diphenyl-thiophen-2-yl]-1,3-benzoxazole Openeye Name: 7-(2-methylbutyl)-2-[5-(2-methylbutyl)-3,4-diphenyl-2-thienyl]-1,3-benzoxazole CAS Name: 7-(2-methylbutyl)-2-[5-(2-methylbutyl)-3,4-diphenyl-2-thiophenyl]-1,3-benzoxazole IUPAC Name: 7-(2-methylbutyl)-2-[5-(2-methylbutyl)-3,4-diphenylthiophen-2-yl]-1,3-benzoxazole Traditional Name: 7-(2-methylbutyl)-2-[5-(2-methylbutyl)-3,4-diphenyl-2-thienyl]-1,3-benzoxazole Formula: C33H35NOS MolecularWeight: 493.7021

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=C2C(=CC=C1)N=C(O2)C3=C(C(=C(S3)CC(C)CC)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC(C)CC1=C2C(=CC=C1)N=C(O2)C3=C(C(=C(S3)CC(C)CC)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H35NOS/c1-5-22(3)20-26-18-13-19-27-31(26)35-33(34-27)32-30(25-16-11-8-12-17-25)29(24-14-9-7-10-15-24)28(36-32)21-23(4)6-2/h7-19,22-23H,5-6,20-21H2,1-4H3