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

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-4-(cyclohexylamino)-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)pyrrole-2,5-dione Traditional Name: 1-benzyl-3-[(4-chlorophenyl)thio]-4-(cyclohexylamino)-3-pyrroline-2,5-quinone Formula: C23H23ClN2O2S MolecularWeight: 426.95892

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H23ClN2O2S/c24-17-11-13-19(14-12-17)29-21-20(25-18-9-5-2-6-10-18)22(27)26(23(21)28)15-16-7-3-1-4-8-16/h1,3-4,7-8,11-14,18,25H,2,5-6,9-10,15H2