1-butyl-N-[4-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-butyl-N-[4-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-butyl-N-[4-[(5-nitrothiazol-2-yl)carbamoyl]phenyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-butyl-N-[4-[[(5-nitro-2-thiazolyl)amino]-oxomethyl]phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-butyl-N-[4-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-butyl-5-keto-N-[4-[(5-nitrothiazol-2-yl)carbamoyl]phenyl]pyrrolidine-3-carboxamide Formula: C19H21N5O5S MolecularWeight: 431.46554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=NC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)NC3=NC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O5S/c1-2-3-8-23-11-13(9-15(23)25)18(27)21-14-6-4-12(5-7-14)17(26)22-19-20-10-16(30-19)24(28)29/h4-7,10,13H,2-3,8-9,11H2,1H3,(H,21,27)(H,20,22,26)