4-(1,3-benzothiazol-2-ylmethyl)-N1-ethyl-N2-methyl-piperazine-1,2-dicarboxamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylmethyl)-N1-ethyl-N2-methyl-piperazine-1,2-dicarboxamide Openeye Name: 4-(1,3-benzothiazol-2-ylmethyl)-N1-ethyl-N2-methyl-piperazine-1,2-dicarboxamide CAS Name: 4-(1,3-benzothiazol-2-ylmethyl)-N1-ethyl-N2-methylpiperazine-1,2-dicarboxamide IUPAC Name: 4-(1,3-benzothiazol-2-ylmethyl)-1-N-ethyl-2-N-methylpiperazine-1,2-dicarboxamide Traditional Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-ethyl-N'-methyl-piperazine-1,2-dicarboxamide Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN(CC1C(=O)NC)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCNC(=O)N1CCN(CC1C(=O)NC)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H23N5O2S/c1-3-19-17(24)22-9-8-21(10-13(22)16(23)18-2)11-15-20-12-6-4-5-7-14(12)25-15/h4-7,13H,3,8-11H2,1-2H3,(H,18,23)(H,19,24)