phenyl 3-(1,3-benzothiazol-2-yl)pyrazine-2-carboxylate

Systemtic Name: phenyl 3-(1,3-benzothiazol-2-yl)pyrazine-2-carboxylate Openeye Name: phenyl 3-(1,3-benzothiazol-2-yl)pyrazine-2-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-2-pyrazinecarboxylic acid phenyl ester IUPAC Name: phenyl 3-(1,3-benzothiazol-2-yl)pyrazine-2-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)pyrazinic acid phenyl ester Formula: C18H11N3O2S MolecularWeight: 333.36384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H11N3O2S/c22-18(23-12-6-2-1-3-7-12)16-15(19-10-11-20-16)17-21-13-8-4-5-9-14(13)24-17/h1-11H