N-[4-[bis(cyanomethyl)carbamoyl]phenyl]-1-butyl-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[4-[bis(cyanomethyl)carbamoyl]phenyl]-1-butyl-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[4-[bis(cyanomethyl)carbamoyl]phenyl]-1-butyl-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[4-[[bis(cyanomethyl)amino]-oxomethyl]phenyl]-1-butyl-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[4-[bis(cyanomethyl)carbamoyl]phenyl]-1-butyl-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[4-[bis(cyanomethyl)carbamoyl]phenyl]-1-butyl-5-keto-pyrrolidine-3-carboxamide Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)N(CC#N)CC#N

Isomeric SMILES

CCCCN1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)N(CC#N)CC#N

InChI

InChI=1S/C20H23N5O3/c1-2-3-10-25-14-16(13-18(25)26)19(27)23-17-6-4-15(5-7-17)20(28)24(11-8-21)12-9-22/h4-7,16H,2-3,10-14H2,1H3,(H,23,27)