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

Systemtic Name: [4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-pentoxyphenyl)methanone Openeye Name: [4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-pentoxyphenyl)methanone CAS Name: [4-(4-methoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-(4-pentoxyphenyl)methanone IUPAC Name: [4-(4-methoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-(4-pentoxyphenyl)methanone Traditional Name: (4-amoxyphenyl)-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C24H29N3O3S MolecularWeight: 439.57036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(C=CC=C4S3)OC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(C=CC=C4S3)OC

InChI

InChI=1S/C24H29N3O3S/c1-3-4-5-17-30-19-11-9-18(10-12-19)23(28)26-13-15-27(16-14-26)24-25-22-20(29-2)7-6-8-21(22)31-24/h6-12H,3-5,13-17H2,1-2H3