3-(4-nitrophenyl)-4-(phenylcarbonyl)-2-piperazin-1-ylcarbonyl-N-propyl-5-thiophen-2-yl-pyrrolidine-1-carboxamide

Systemtic Name: 3-(4-nitrophenyl)-4-(phenylcarbonyl)-2-piperazin-1-ylcarbonyl-N-propyl-5-thiophen-2-yl-pyrrolidine-1-carboxamide Openeye Name: 4-benzoyl-3-(4-nitrophenyl)-2-(piperazine-1-carbonyl)-N-propyl-5-(2-thienyl)pyrrolidine-1-carboxamide CAS Name: 4-benzoyl-3-(4-nitrophenyl)-2-[oxo(1-piperazinyl)methyl]-N-propyl-5-thiophen-2-yl-1-pyrrolidinecarboxamide IUPAC Name: 4-benzoyl-3-(4-nitrophenyl)-2-(piperazine-1-carbonyl)-N-propyl-5-thiophen-2-ylpyrrolidine-1-carboxamide Traditional Name: 4-benzoyl-3-(4-nitrophenyl)-2-(piperazine-1-carbonyl)-N-propyl-5-(2-thienyl)pyrrolidine-1-carboxamide Formula: C30H33N5O5S MolecularWeight: 575.67852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1C(C(C(C1C(=O)N2CCNCC2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

CCCNC(=O)N1C(C(C(C1C(=O)N2CCNCC2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C30H33N5O5S/c1-2-14-32-30(38)34-26(23-9-6-19-41-23)25(28(36)21-7-4-3-5-8-21)24(20-10-12-22(13-11-20)35(39)40)27(34)29(37)33-17-15-31-16-18-33/h3-13,19,24-27,31H,2,14-18H2,1H3,(H,32,38)