N-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-4-bromanyl-1-methoxy-naphthalene-2-carboxamide

Systemtic Name: N-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-4-bromanyl-1-methoxy-naphthalene-2-carboxamide Openeye Name: N-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-4-bromo-1-methoxy-naphthalene-2-carboxamide CAS Name: N-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]-4-bromo-1-methoxy-2-naphthalenecarboxamide IUPAC Name: N-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-4-bromo-1-methoxynaphthalene-2-carboxamide Traditional Name: N-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]-4-bromo-1-methoxy-2-naphthamide Formula: C25H25BrN4O2S MolecularWeight: 525.4606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C2=CC=CC=C21)Br)C(=O)NCCN3CCN(CC3)C4=NSC5=CC=CC=C54

Isomeric SMILES

COC1=C(C=C(C2=CC=CC=C21)Br)C(=O)NCCN3CCN(CC3)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C25H25BrN4O2S/c1-32-23-18-7-3-2-6-17(18)21(26)16-20(23)25(31)27-10-11-29-12-14-30(15-13-29)24-19-8-4-5-9-22(19)33-28-24/h2-9,16H,10-15H2,1H3,(H,27,31)