ethyl 4-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[(2-methyl-1H-indol-3-yl)thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(2-methyl-1H-indol-3-yl)thio]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CSC2=C(NC3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CSC2=C(NC3=CC=CC=C32)C

InChI

InChI=1S/C18H23N3O3S/c1-3-24-18(23)21-10-8-20(9-11-21)16(22)12-25-17-13(2)19-15-7-5-4-6-14(15)17/h4-7,19H,3,8-12H2,1-2H3