1-[[4-(dimethylaminomethyl)-1,3-benzothiazol-2-yl]carbonyl]-N-methyl-piperazine-2-carboxamide

Systemtic Name: 1-[[4-(dimethylaminomethyl)-1,3-benzothiazol-2-yl]carbonyl]-N-methyl-piperazine-2-carboxamide Openeye Name: 1-[4-(dimethylaminomethyl)-1,3-benzothiazole-2-carbonyl]-N-methyl-piperazine-2-carboxamide CAS Name: 1-[[4-(dimethylaminomethyl)-1,3-benzothiazol-2-yl]-oxomethyl]-N-methyl-2-piperazinecarboxamide IUPAC Name: 1-[4-(dimethylaminomethyl)-1,3-benzothiazole-2-carbonyl]-N-methylpiperazine-2-carboxamide Traditional Name: 1-[4-(dimethylaminomethyl)-1,3-benzothiazole-2-carbonyl]-N-methyl-piperazine-2-carboxamide Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CNCCN1C(=O)C2=NC3=C(C=CC=C3S2)CN(C)C

Isomeric SMILES

CNC(=O)C1CNCCN1C(=O)C2=NC3=C(C=CC=C3S2)CN(C)C

InChI

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