3-(cyclohexylamino)-1-(4-ethylphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione

Systemtic Name: 3-(cyclohexylamino)-1-(4-ethylphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 3-(cyclohexylamino)-1-(4-ethylphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 3-(cyclohexylamino)-1-(4-ethylphenyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 3-(cyclohexylamino)-1-(4-ethylphenyl)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 3-(cyclohexylamino)-1-(4-ethylphenyl)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C24H26N2O2S MolecularWeight: 406.54044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4CCCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4CCCCC4

InChI

InChI=1S/C24H26N2O2S/c1-2-17-13-15-19(16-14-17)26-23(27)21(25-18-9-5-3-6-10-18)22(24(26)28)29-20-11-7-4-8-12-20/h4,7-8,11-16,18,25H,2-3,5-6,9-10H2,1H3