[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-butoxyphenyl)methanone

Systemtic Name: [4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-butoxyphenyl)methanone Openeye Name: [4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-butoxyphenyl)methanone CAS Name: [4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-(4-butoxyphenyl)methanone IUPAC Name: [4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-butoxyphenyl)methanone Traditional Name: [4-(1,3-benzothiazol-2-yl)piperazino]-(4-butoxyphenyl)methanone Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H25N3O2S/c1-2-3-16-27-18-10-8-17(9-11-18)21(26)24-12-14-25(15-13-24)22-23-19-6-4-5-7-20(19)28-22/h4-11H,2-3,12-16H2,1H3