3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[2-(2-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-[2-(2-methoxyphenyl)-2-pyrrolidino-ethyl]propionamide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNC(=O)CCSCC(=O)N)N2CCCC2

Isomeric SMILES

COC1=CC=CC=C1C(CNC(=O)CCSCC(=O)N)N2CCCC2

InChI

InChI=1S/C18H27N3O3S/c1-24-16-7-3-2-6-14(16)15(21-9-4-5-10-21)12-20-18(23)8-11-25-13-17(19)22/h2-3,6-7,15H,4-5,8-13H2,1H3,(H2,19,22)(H,20,23)