3-[4-(5-ethoxy-6-methoxy-cyclohexa-1,5-dien-1-yl)piperazin-1-yl]-1,2-benzothiazole

Systemtic Name: 3-[4-(5-ethoxy-6-methoxy-cyclohexa-1,5-dien-1-yl)piperazin-1-yl]-1,2-benzothiazole Openeye Name: 3-[4-(5-ethoxy-6-methoxy-cyclohexa-1,5-dien-1-yl)piperazin-1-yl]-1,2-benzothiazole CAS Name: 3-[4-(5-ethoxy-6-methoxy-1-cyclohexa-1,5-dienyl)-1-piperazinyl]-1,2-benzothiazole IUPAC Name: 3-[4-(5-ethoxy-6-methoxycyclohexa-1,5-dien-1-yl)piperazin-1-yl]-1,2-benzothiazole Traditional Name: 3-[4-(5-ethoxy-6-methoxy-cyclohexa-1,5-dien-1-yl)piperazino]-1,2-benzothiazole Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CCC1)N2CCN(CC2)C3=NSC4=CC=CC=C43)OC

Isomeric SMILES

CCOC1=C(C(=CCC1)N2CCN(CC2)C3=NSC4=CC=CC=C43)OC

InChI

InChI=1S/C20H25N3O2S/c1-3-25-17-9-6-8-16(19(17)24-2)22-11-13-23(14-12-22)20-15-7-4-5-10-18(15)26-21-20/h4-5,7-8,10H,3,6,9,11-14H2,1-2H3