2-(3,4-diphenylthiophen-2-yl)-5,7-bis(2-methylbutyl)-1,3-benzoxazole

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CS3)C4=CC=CC=C4)C5=CC=CC=C5)CC(C)CC

Isomeric SMILES

CCC(C)CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CS3)C4=CC=CC=C4)C5=CC=CC=C5)CC(C)CC

InChI

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