4-[2-[4-(2,4-dichlorophenyl)sulfanyl-3-nitro-phenyl]prop-2-enoyl]-N,N-diethyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-[4-(2,4-dichlorophenyl)sulfanyl-3-nitro-phenyl]prop-2-enoyl]-N,N-diethyl-piperazine-1-carboxamide Openeye Name: 4-[2-[4-(2,4-dichlorophenyl)sulfanyl-3-nitro-phenyl]prop-2-enoyl]-N,N-diethyl-piperazine-1-carboxamide CAS Name: 4-[2-[4-[(2,4-dichlorophenyl)thio]-3-nitrophenyl]-1-oxoprop-2-enyl]-N,N-diethyl-1-piperazinecarboxamide IUPAC Name: 4-[2-[4-(2,4-dichlorophenyl)sulfanyl-3-nitrophenyl]prop-2-enoyl]-N,N-diethylpiperazine-1-carboxamide Traditional Name: 4-[2-[4-[(2,4-dichlorophenyl)thio]-3-nitro-phenyl]acryloyl]-N,N-diethyl-piperazine-1-carboxamide Formula: C24H26Cl2N4O4S MolecularWeight: 537.45864

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCN(CC1)C(=O)C(=C)C2=CC(=C(C=C2)SC3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)N1CCN(CC1)C(=O)C(=C)C2=CC(=C(C=C2)SC3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H26Cl2N4O4S/c1-4-27(5-2)24(32)29-12-10-28(11-13-29)23(31)16(3)17-6-8-22(20(14-17)30(33)34)35-21-9-7-18(25)15-19(21)26/h6-9,14-15H,3-5,10-13H2,1-2H3