3-[4-[2-[2-(2-methoxy-4-prop-2-enyl-phenoxy)ethoxy]ethyl]piperazin-1-yl]-1,2-benzothiazole

Systemtic Name: 3-[4-[2-[2-(2-methoxy-4-prop-2-enyl-phenoxy)ethoxy]ethyl]piperazin-1-yl]-1,2-benzothiazole Openeye Name: 3-[4-[2-[2-(4-allyl-2-methoxy-phenoxy)ethoxy]ethyl]piperazin-1-yl]-1,2-benzothiazole CAS Name: 3-[4-[2-[2-(2-methoxy-4-prop-2-enylphenoxy)ethoxy]ethyl]-1-piperazinyl]-1,2-benzothiazole IUPAC Name: 3-[4-[2-[2-(2-methoxy-4-prop-2-enylphenoxy)ethoxy]ethyl]piperazin-1-yl]-1,2-benzothiazole Traditional Name: 3-[4-[2-[2-(4-allyl-2-methoxy-phenoxy)ethoxy]ethyl]piperazino]-1,2-benzothiazole Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCCOCCN2CCN(CC2)C3=NSC4=CC=CC=C43

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCCOCCN2CCN(CC2)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C25H31N3O3S/c1-3-6-20-9-10-22(23(19-20)29-2)31-18-17-30-16-15-27-11-13-28(14-12-27)25-21-7-4-5-8-24(21)32-26-25/h3-5,7-10,19H,1,6,11-18H2,2H3