tert-butyl 4-[2-[3-[(6-chloranylnaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]propanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[3-[(6-chloranylnaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]propanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[3-[(6-chloro-2-naphthyl)sulfonylamino]-2-oxo-pyrrolidin-1-yl]propanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[3-[(6-chloro-2-naphthalenyl)sulfonylamino]-2-oxo-1-pyrrolidinyl]-1-oxopropyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[3-[(6-chloronaphthalen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]propanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[3-[(6-chloro-2-naphthyl)sulfonylamino]-2-keto-pyrrolidino]propanoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C26H33ClN4O6S MolecularWeight: 565.08142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C(=O)OC(C)(C)C)N2CCC(C2=O)NS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C(=O)OC(C)(C)C)N2CCC(C2=O)NS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

InChI

InChI=1S/C26H33ClN4O6S/c1-17(23(32)29-11-13-30(14-12-29)25(34)37-26(2,3)4)31-10-9-22(24(31)33)28-38(35,36)21-8-6-18-15-20(27)7-5-19(18)16-21/h5-8,15-17,22,28H,9-14H2,1-4H3