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

Systemtic Name: 2-[[4-(2-propylpentanoyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Openeye Name: 2-[[4-(2-propylpentanoyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one CAS Name: 2-[[4-(1-oxo-2-propylpentyl)-1-piperazinyl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one IUPAC Name: 2-[[4-(2-propylpentanoyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Traditional Name: 2-[[4-(2-propylpentanoyl)piperazino]methyl]-5,6-dihydro-4H-1,3-benzothiazol-7-one Formula: C20H31N3O2S MolecularWeight: 377.54404

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)N1CCN(CC1)CC2=NC3=C(S2)C(=O)CCC3

Isomeric SMILES

CCCC(CCC)C(=O)N1CCN(CC1)CC2=NC3=C(S2)C(=O)CCC3

InChI

InChI=1S/C20H31N3O2S/c1-3-6-15(7-4-2)20(25)23-12-10-22(11-13-23)14-18-21-16-8-5-9-17(24)19(16)26-18/h15H,3-14H2,1-2H3