1-(4-carbamimidoylphenyl)-3-(2-methylsulfanylethyl)-4,6-bis(oxidanylidene)-5-phenyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid

Systemtic Name: 1-(4-carbamimidoylphenyl)-3-(2-methylsulfanylethyl)-4,6-bis(oxidanylidene)-5-phenyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Openeye Name: 1-(4-carbamimidoylphenyl)-3-(2-methylsulfanylethyl)-4,6-dioxo-5-phenyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid CAS Name: 1-(4-carbamimidoylphenyl)-3-[2-(methylthio)ethyl]-4,6-dioxo-5-phenyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid IUPAC Name: 1-(4-carbamimidoylphenyl)-3-(2-methylsulfanylethyl)-4,6-dioxo-5-phenyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Traditional Name: 1-(4-amidinophenyl)-4,6-diketo-3-[2-(methylthio)ethyl]-5-phenyl-1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3-carboxylic acid Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC1(C2C(C(N1)C3=CC=C(C=C3)C(=N)N)C(=O)N(C2=O)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CSCCC1(C2C(C(N1)C3=CC=C(C=C3)C(=N)N)C(=O)N(C2=O)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H24N4O4S/c1-32-12-11-23(22(30)31)17-16(18(26-23)13-7-9-14(10-8-13)19(24)25)20(28)27(21(17)29)15-5-3-2-4-6-15/h2-10,16-18,26H,11-12H2,1H3,(H3,24,25)(H,30,31)