2-[[4-[2-(2-methylphenoxy)ethanoyl]piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one

Systemtic Name: 2-[[4-[2-(2-methylphenoxy)ethanoyl]piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Openeye Name: 2-[[4-[2-(2-methylphenoxy)acetyl]piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one CAS Name: 2-[[4-[2-(2-methylphenoxy)-1-oxoethyl]-1-piperazinyl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one IUPAC Name: 2-[[4-[2-(2-methylphenoxy)acetyl]piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Traditional Name: 2-[[4-[2-(2-methylphenoxy)acetyl]piperazino]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)N2CCN(CC2)CC3=NC4=C(S3)C(=O)CCC4

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)N2CCN(CC2)CC3=NC4=C(S3)C(=O)CCC4

InChI

InChI=1S/C21H25N3O3S/c1-15-5-2-3-8-18(15)27-14-20(26)24-11-9-23(10-12-24)13-19-22-16-6-4-7-17(25)21(16)28-19/h2-3,5,8H,4,6-7,9-14H2,1H3