(3-butoxyphenyl)-[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (3-butoxyphenyl)-[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (3-butoxyphenyl)-[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (3-butoxyphenyl)-[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (3-butoxyphenyl)-[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (3-butoxyphenyl)-[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O2S/c1-4-5-15-29-20-8-6-7-19(16-20)23(28)26-11-13-27(14-12-26)24-25-21-17(2)9-10-18(3)22(21)30-24/h6-10,16H,4-5,11-15H2,1-3H3