N-butyl-4-methyl-piperazine-1-carbothioamide; ethanedioic acid

Systemtic Name: N-butyl-4-methyl-piperazine-1-carbothioamide; ethanedioic acid Openeye Name: N-butyl-4-methyl-piperazine-1-carbothioamide; oxalic acid CAS Name: N-butyl-4-methyl-1-piperazinecarbothioamide; oxalic acid IUPAC Name: N-butyl-4-methylpiperazine-1-carbothioamide; oxalic acid Traditional Name: N-butyl-4-methyl-piperazine-1-carbothioamide; oxalic acid Formula: C12H23N3O4S MolecularWeight: 305.39372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CCN(CC1)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCNC(=S)N1CCN(CC1)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C10H21N3S.C2H2O4/c1-3-4-5-11-10(14)13-8-6-12(2)7-9-13;3-1(4)2(5)6/h3-9H2,1-2H3,(H,11,14);(H,3,4)(H,5,6)