tert-butyl N-[4-oxidanylidene-4-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]butyl]carbamate

Systemtic Name: tert-butyl N-[4-oxidanylidene-4-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]butyl]carbamate Openeye Name: tert-butyl N-[4-oxo-4-(3-pyrrolidin-1-ylsulfonylanilino)butyl]carbamate CAS Name: N-[4-oxo-4-[3-(1-pyrrolidinylsulfonyl)anilino]butyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-oxo-4-(3-pyrrolidin-1-ylsulfonylanilino)butyl]carbamate Traditional Name: N-[4-keto-4-(3-pyrrolidinosulfonylanilino)butyl]carbamic acid tert-butyl ester Formula: C19H29N3O5S MolecularWeight: 411.51566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(C)(C)OC(=O)NCCCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C19H29N3O5S/c1-19(2,3)27-18(24)20-11-7-10-17(23)21-15-8-6-9-16(14-15)28(25,26)22-12-4-5-13-22/h6,8-9,14H,4-5,7,10-13H2,1-3H3,(H,20,24)(H,21,23)