3-[(4-ethoxyphenyl)amino]-1-(phenylmethyl)-4-phenylsulfanyl-pyrrole-2,5-dione

Systemtic Name: 3-[(4-ethoxyphenyl)amino]-1-(phenylmethyl)-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(4-ethoxyanilino)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 3-(4-ethoxyanilino)-1-(phenylmethyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(4-ethoxyanilino)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 1-benzyl-3-(phenylthio)-4-(p-phenetidino)-3-pyrroline-2,5-quinone Formula: C25H22N2O3S MolecularWeight: 430.51878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O3S/c1-2-30-20-15-13-19(14-16-20)26-22-23(31-21-11-7-4-8-12-21)25(29)27(24(22)28)17-18-9-5-3-6-10-18/h3-16,26H,2,17H2,1H3