[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3-propan-2-ylsulfonylphenyl)methanone

Systemtic Name: [4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3-propan-2-ylsulfonylphenyl)methanone Openeye Name: [4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3-isopropylsulfonylphenyl)methanone CAS Name: [4-(6-ethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-(3-propan-2-ylsulfonylphenyl)methanone IUPAC Name: [4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(3-propan-2-ylsulfonylphenyl)methanone Traditional Name: [4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazino]-(3-isopropylsulfonylphenyl)methanone Formula: C23H27N3O4S2 MolecularWeight: 473.60818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)S(=O)(=O)C(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)S(=O)(=O)C(C)C

InChI

InChI=1S/C23H27N3O4S2/c1-4-30-18-8-9-20-21(15-18)31-23(24-20)26-12-10-25(11-13-26)22(27)17-6-5-7-19(14-17)32(28,29)16(2)3/h5-9,14-16H,4,10-13H2,1-3H3