3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-phenethyl-pyrrole-2,5-dione

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-phenethyl-pyrrole-2,5-dione Openeye Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-phenethyl-pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-4-(cyclohexylamino)-1-phenethylpyrrole-2,5-dione IUPAC Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-phenethylpyrrole-2,5-dione Traditional Name: 3-[(4-chlorophenyl)thio]-4-(cyclohexylamino)-1-phenethyl-3-pyrroline-2,5-quinone Formula: C24H25ClN2O2S MolecularWeight: 440.9855

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H25ClN2O2S/c25-18-11-13-20(14-12-18)30-22-21(26-19-9-5-2-6-10-19)23(28)27(24(22)29)16-15-17-7-3-1-4-8-17/h1,3-4,7-8,11-14,19,26H,2,5-6,9-10,15-16H2