N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-[(2S)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C23H31N3O4S2 MolecularWeight: 477.63994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC(C3=CC=CS3)N4CCOCC4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC[C@@H](C3=CC=CS3)N4CCOCC4

InChI

InChI=1S/C23H31N3O4S2/c27-23(24-18-21(22-4-3-17-31-22)25-13-15-30-16-14-25)10-7-19-5-8-20(9-6-19)32(28,29)26-11-1-2-12-26/h3-6,8-9,17,21H,1-2,7,10-16,18H2,(H,24,27)/t21-/m0/s1