4-[2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-3-methyl-pentanoyl]-N-propan-2-yl-piperazine-1-carboxamide

Systemtic Name: 4-[2-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-3-methyl-pentanoyl]-N-propan-2-yl-piperazine-1-carboxamide Openeye Name: 4-[2-[(4-chloro-3-nitro-phenyl)sulfonylamino]-3-methyl-pentanoyl]-N-isopropyl-piperazine-1-carboxamide CAS Name: 4-[2-[(4-chloro-3-nitrophenyl)sulfonylamino]-3-methyl-1-oxopentyl]-N-propan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[2-[(4-chloro-3-nitrophenyl)sulfonylamino]-3-methylpentanoyl]-N-propan-2-ylpiperazine-1-carboxamide Traditional Name: 4-[2-[(4-chloro-3-nitro-phenyl)sulfonylamino]-3-methyl-pentanoyl]-N-isopropyl-piperazine-1-carboxamide Formula: C20H30ClN5O6S MolecularWeight: 504.0001

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C(=O)NC(C)C)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(CC1)C(=O)NC(C)C)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H30ClN5O6S/c1-5-14(4)18(19(27)24-8-10-25(11-9-24)20(28)22-13(2)3)23-33(31,32)15-6-7-16(21)17(12-15)26(29)30/h6-7,12-14,18,23H,5,8-11H2,1-4H3,(H,22,28)