3-[2-[4-(6-bromanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[2-[4-(6-bromanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one Openeye Name: 3-[2-[4-(6-bromo-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxo-ethyl]-1,3-benzoxazol-2-one CAS Name: 3-[2-[4-(6-bromo-1,3-benzothiazol-2-yl)-1-piperazinyl]-2-oxoethyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[2-[4-(6-bromo-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxoethyl]-1,3-benzoxazol-2-one Traditional Name: 3-[2-[4-(6-bromo-1,3-benzothiazol-2-yl)piperazino]-2-keto-ethyl]-1,3-benzoxazol-2-one Formula: C20H17BrN4O3S MolecularWeight: 473.34298

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)Br)C(=O)CN4C5=CC=CC=C5OC4=O

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)Br)C(=O)CN4C5=CC=CC=C5OC4=O

InChI

InChI=1S/C20H17BrN4O3S/c21-13-5-6-14-17(11-13)29-19(22-14)24-9-7-23(8-10-24)18(26)12-25-15-3-1-2-4-16(15)28-20(25)27/h1-6,11H,7-10,12H2