S-[2-[[2-dimethylaminoethyl(phenethyl)carbamoyl]amino]-3-phenyl-propyl] ethanethioate

Systemtic Name: S-[2-[[2-dimethylaminoethyl(phenethyl)carbamoyl]amino]-3-phenyl-propyl] ethanethioate Openeye Name: S-[2-[[2-dimethylaminoethyl(phenethyl)carbamoyl]amino]-3-phenyl-propyl] ethanethioate CAS Name: ethanethioic acid S-[2-[[[2-dimethylaminoethyl(phenethyl)amino]-oxomethyl]amino]-3-phenylpropyl] ester IUPAC Name: S-[2-[[2-dimethylaminoethyl(phenethyl)carbamoyl]amino]-3-phenylpropyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[[2-dimethylaminoethyl(phenethyl)carbamoyl]amino]-3-phenyl-propyl] ester Formula: C24H33N3O2S MolecularWeight: 427.60272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CC1=CC=CC=C1)NC(=O)N(CCC2=CC=CC=C2)CCN(C)C

Isomeric SMILES

CC(=O)SCC(CC1=CC=CC=C1)NC(=O)N(CCC2=CC=CC=C2)CCN(C)C

InChI

InChI=1S/C24H33N3O2S/c1-20(28)30-19-23(18-22-12-8-5-9-13-22)25-24(29)27(17-16-26(2)3)15-14-21-10-6-4-7-11-21/h4-13,23H,14-19H2,1-3H3,(H,25,29)