1-[2-oxidanylidene-2-[2-(4-pyrrolidin-1-ylsulfonylphenyl)carbonylhydrazinyl]ethyl]-3-(phenylmethyl)urea

Systemtic Name: 1-[2-oxidanylidene-2-[2-(4-pyrrolidin-1-ylsulfonylphenyl)carbonylhydrazinyl]ethyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[2-oxo-2-[2-(4-pyrrolidin-1-ylsulfonylbenzoyl)hydrazino]ethyl]urea CAS Name: 1-[2-oxo-2-[[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]hydrazo]ethyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[2-oxo-2-[2-(4-pyrrolidin-1-ylsulfonylbenzoyl)hydrazinyl]ethyl]urea Traditional Name: 1-benzyl-3-[2-keto-2-[N'-(4-pyrrolidinosulfonylbenzoyl)hydrazino]ethyl]urea Formula: C21H25N5O5S MolecularWeight: 459.5187

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)CNC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)CNC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H25N5O5S/c27-19(15-23-21(29)22-14-16-6-2-1-3-7-16)24-25-20(28)17-8-10-18(11-9-17)32(30,31)26-12-4-5-13-26/h1-3,6-11H,4-5,12-15H2,(H,24,27)(H,25,28)(H2,22,23,29)