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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1NC2=C(C(=O)N(C2=O)CC3=CC=CC=C3)SC4=CC=CC=C4

InChI

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