3-azanyl-5-(4-chlorophenyl)-1-(4-ethoxyphenyl)-2-sulfanyl-pyrrolo[3,4-b]pyrrole-4,6-dione

Systemtic Name: 3-azanyl-5-(4-chlorophenyl)-1-(4-ethoxyphenyl)-2-sulfanyl-pyrrolo[3,4-b]pyrrole-4,6-dione Openeye Name: 3-amino-5-(4-chlorophenyl)-1-(4-ethoxyphenyl)-2-sulfanyl-pyrrolo[3,4-b]pyrrole-4,6-dione CAS Name: 3-amino-5-(4-chlorophenyl)-1-(4-ethoxyphenyl)-2-mercaptopyrrolo[3,4-b]pyrrole-4,6-dione IUPAC Name: 3-amino-5-(4-chlorophenyl)-1-(4-ethoxyphenyl)-2-sulfanylpyrrolo[3,4-b]pyrrole-4,6-dione Traditional Name: 3-amino-5-(4-chlorophenyl)-2-mercapto-1-p-phenetyl-pyrrolo[3,4-b]pyrrole-4,6-quinone Formula: C20H16ClN3O3S MolecularWeight: 413.87734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=C(C(=C2S)N)C(=O)N(C3=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=C(C(=C2S)N)C(=O)N(C3=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H16ClN3O3S/c1-2-27-14-9-7-12(8-10-14)23-17-15(16(22)20(23)28)18(25)24(19(17)26)13-5-3-11(21)4-6-13/h3-10,28H,2,22H2,1H3