3-(1,3-benzothiazol-2-yl)-N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]pyrazine-2-carboxamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]pyrazine-2-carboxamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[4-(4-ethyl-1-piperazinyl)-3-methylphenyl]-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]pyrazine-2-carboxamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[4-(4-ethylpiperazino)-3-methyl-phenyl]pyrazinamide Formula: C25H26N6OS MolecularWeight: 458.57854

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C25H26N6OS/c1-3-30-12-14-31(15-13-30)20-9-8-18(16-17(20)2)28-24(32)22-23(27-11-10-26-22)25-29-19-6-4-5-7-21(19)33-25/h4-11,16H,3,12-15H2,1-2H3,(H,28,32)