(2-ethoxynaphthalen-1-yl)-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (2-ethoxynaphthalen-1-yl)-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (2-ethoxy-1-naphthyl)-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (2-ethoxy-1-naphthalenyl)-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (2-ethoxynaphthalen-1-yl)-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (2-ethoxy-1-naphthyl)-[4-(6-mesyl-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C25H25N3O4S2 MolecularWeight: 495.6137

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C25H25N3O4S2/c1-3-32-21-11-8-17-6-4-5-7-19(17)23(21)24(29)27-12-14-28(15-13-27)25-26-20-10-9-18(34(2,30)31)16-22(20)33-25/h4-11,16H,3,12-15H2,1-2H3