S-[2-[2-(aminocarbonylamino)-4-methyl-1-propanoyl-piperazin-2-yl]ethyl] ethanethioate

Systemtic Name: S-[2-[2-(aminocarbonylamino)-4-methyl-1-propanoyl-piperazin-2-yl]ethyl] ethanethioate Openeye Name: S-[2-(4-methyl-1-propanoyl-2-ureido-piperazin-2-yl)ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[2-(carbamoylamino)-4-methyl-1-(1-oxopropyl)-2-piperazinyl]ethyl] ester IUPAC Name: S-[2-[2-(carbamoylamino)-4-methyl-1-propanoylpiperazin-2-yl]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-(4-methyl-1-propionyl-2-ureido-piperazin-2-yl)ethyl] ester Formula: C13H24N4O3S MolecularWeight: 316.41966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1(CCSC(=O)C)NC(=O)N)C

Isomeric SMILES

CCC(=O)N1CCN(CC1(CCSC(=O)C)NC(=O)N)C

InChI

InChI=1S/C13H24N4O3S/c1-4-11(19)17-7-6-16(3)9-13(17,15-12(14)20)5-8-21-10(2)18/h4-9H2,1-3H3,(H3,14,15,20)