3-(1,3-benzothiazol-2-yl)-N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]pyrazine-2-carboxamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-bromoanilino)-2-oxo-ethyl]pyrazine-2-carboxamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-bromoanilino)-2-oxoethyl]-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-bromoanilino)-2-oxoethyl]pyrazine-2-carboxamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-bromoanilino)-2-keto-ethyl]pyrazinamide Formula: C20H14BrN5O2S MolecularWeight: 468.32646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=NC=CN=C3C(=O)NCC(=O)NC4=CC=CC=C4Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=NC=CN=C3C(=O)NCC(=O)NC4=CC=CC=C4Br

InChI

InChI=1S/C20H14BrN5O2S/c21-12-5-1-2-6-13(12)25-16(27)11-24-19(28)17-18(23-10-9-22-17)20-26-14-7-3-4-8-15(14)29-20/h1-10H,11H2,(H,24,28)(H,25,27)