ethanedioic acid; 5-methyl-1-pyridin-2-yl-2-[(E)-2-thiophen-2-ylethenyl]benzimidazole

Systemtic Name: ethanedioic acid; 5-methyl-1-pyridin-2-yl-2-[(E)-2-thiophen-2-ylethenyl]benzimidazole Openeye Name: 5-methyl-1-(2-pyridyl)-2-[(E)-2-(2-thienyl)vinyl]benzimidazole; oxalic acid CAS Name: 5-methyl-1-(2-pyridinyl)-2-[(E)-2-thiophen-2-ylethenyl]benzimidazole; oxalic acid IUPAC Name: 5-methyl-1-pyridin-2-yl-2-[(E)-2-thiophen-2-ylethenyl]benzimidazole; oxalic acid Traditional Name: 5-methyl-1-(2-pyridyl)-2-[(E)-2-(2-thienyl)vinyl]benzimidazole; oxalic acid Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=N2)C=CC3=CC=CS3)C4=CC=CC=N4.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=N2)/C=C/C3=CC=CS3)C4=CC=CC=N4.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H15N3S.C2H2O4/c1-14-7-9-17-16(13-14)21-19(10-8-15-5-4-12-23-15)22(17)18-6-2-3-11-20-18;3-1(4)2(5)6/h2-13H,1H3;(H,3,4)(H,5,6)/b10-8+;