(3,4-dimethylphenyl) 3-(1,3-benzothiazol-2-yl)pyrazine-2-carboxylate

Systemtic Name: (3,4-dimethylphenyl) 3-(1,3-benzothiazol-2-yl)pyrazine-2-carboxylate Openeye Name: (3,4-dimethylphenyl) 3-(1,3-benzothiazol-2-yl)pyrazine-2-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-2-pyrazinecarboxylic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 3-(1,3-benzothiazol-2-yl)pyrazine-2-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)pyrazinic acid (3,4-dimethylphenyl) ester Formula: C20H15N3O2S MolecularWeight: 361.417

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C20H15N3O2S/c1-12-7-8-14(11-13(12)2)25-20(24)18-17(21-9-10-22-18)19-23-15-5-3-4-6-16(15)26-19/h3-11H,1-2H3