S-[2-[2-cyclobutylethyl-[[1-(4-methylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]carbamoyl]amino]ethyl] ethanethioate

Systemtic Name: S-[2-[2-cyclobutylethyl-[[1-(4-methylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]carbamoyl]amino]ethyl] ethanethioate Openeye Name: S-[2-[2-cyclobutylethyl-[[1-methyl-2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]carbamoyl]amino]ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[2-cyclobutylethyl-[[[1-(4-methyl-1-piperazinyl)-1-oxopropan-2-yl]amino]-oxomethyl]amino]ethyl] ester IUPAC Name: S-[2-[2-cyclobutylethyl-[[1-(4-methylpiperazin-1-yl)-1-oxopropan-2-yl]carbamoyl]amino]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[2-cyclobutylethyl-[[2-keto-1-methyl-2-(4-methylpiperazino)ethyl]carbamoyl]amino]ethyl] ester Formula: C19H34N4O3S MolecularWeight: 398.56326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C)NC(=O)N(CCC2CCC2)CCSC(=O)C

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C)NC(=O)N(CCC2CCC2)CCSC(=O)C

InChI

InChI=1S/C19H34N4O3S/c1-15(18(25)22-11-9-21(3)10-12-22)20-19(26)23(13-14-27-16(2)24)8-7-17-5-4-6-17/h15,17H,4-14H2,1-3H3,(H,20,26)