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

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-ethylanilino)-2-oxo-ethyl]-N-methyl-pyrazine-2-carboxamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methylpyrazine-2-carboxamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-ethylanilino)-2-keto-ethyl]-N-methyl-pyrazinamide Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C2=NC=CN=C2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H21N5O2S/c1-3-15-8-4-5-9-16(15)26-19(29)14-28(2)23(30)21-20(24-12-13-25-21)22-27-17-10-6-7-11-18(17)31-22/h4-13H,3,14H2,1-2H3,(H,26,29)