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

Systemtic Name: [4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-ethylsulfanylphenyl)methanone Openeye Name: [4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-ethylsulfanylphenyl)methanone CAS Name: [4-(6-ethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-[2-(ethylthio)phenyl]methanone IUPAC Name: [4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(2-ethylsulfanylphenyl)methanone Traditional Name: [4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazino]-[2-(ethylthio)phenyl]methanone Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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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=C4SCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C(=O)C4=CC=CC=C4SCC

InChI

InChI=1S/C22H25N3O2S2/c1-3-27-16-9-10-18-20(15-16)29-22(23-18)25-13-11-24(12-14-25)21(26)17-7-5-6-8-19(17)28-4-2/h5-10,15H,3-4,11-14H2,1-2H3