2-[6-methyl-5-[(E)-2-thiophen-2-ylethenyl]-1,2,4-triazin-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[6-methyl-5-[(E)-2-thiophen-2-ylethenyl]-1,2,4-triazin-3-yl]isoindole-1,3-dione Openeye Name: 2-[6-methyl-5-[(E)-2-(2-thienyl)vinyl]-1,2,4-triazin-3-yl]isoindoline-1,3-dione CAS Name: 2-[6-methyl-5-[(E)-2-thiophen-2-ylethenyl]-1,2,4-triazin-3-yl]isoindole-1,3-dione IUPAC Name: 2-[6-methyl-5-[(E)-2-thiophen-2-ylethenyl]-1,2,4-triazin-3-yl]isoindole-1,3-dione Traditional Name: 2-[6-methyl-5-[(E)-2-(2-thienyl)vinyl]-1,2,4-triazin-3-yl]isoindoline-1,3-quinone Formula: C18H12N4O2S MolecularWeight: 348.37848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)N2C(=O)C3=CC=CC=C3C2=O)C=CC4=CC=CS4

Isomeric SMILES

CC1=C(N=C(N=N1)N2C(=O)C3=CC=CC=C3C2=O)/C=C/C4=CC=CS4

InChI

InChI=1S/C18H12N4O2S/c1-11-15(9-8-12-5-4-10-25-12)19-18(21-20-11)22-16(23)13-6-2-3-7-14(13)17(22)24/h2-10H,1H3/b9-8+