propan-2-ylbenzene; 2-thiophen-2-yl-1,3-benzoxazole

Systemtic Name: propan-2-ylbenzene; 2-thiophen-2-yl-1,3-benzoxazole Openeye Name: cumene; 2-(2-thienyl)-1,3-benzoxazole CAS Name: cumene; 2-thiophen-2-yl-1,3-benzoxazole IUPAC Name: cumene; 2-thiophen-2-yl-1,3-benzoxazole Traditional Name: cumene; 2-(2-thienyl)-1,3-benzoxazole Formula: C20H19NOS MolecularWeight: 321.43596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1.C1=CC=C2C(=C1)N=C(O2)C3=CC=CS3

Isomeric SMILES

CC(C)C1=CC=CC=C1.C1=CC=C2C(=C1)N=C(O2)C3=CC=CS3

InChI

InChI=1S/C11H7NOS.C9H12/c1-2-5-9-8(4-1)12-11(13-9)10-6-3-7-14-10;1-8(2)9-6-4-3-5-7-9/h1-7H;3-8H,1-2H3