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

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[(2,4-dimethylphenyl)methyl]-N-methyl-pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[(2,4-dimethylphenyl)methyl]-N-methyl-pyrazine-2-carboxamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[(2,4-dimethylphenyl)methyl]-N-methyl-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[(2,4-dimethylphenyl)methyl]-N-methylpyrazine-2-carboxamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-(2,4-dimethylbenzyl)-N-methyl-pyrazinamide Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N4OS/c1-14-8-9-16(15(2)12-14)13-26(3)22(27)20-19(23-10-11-24-20)21-25-17-6-4-5-7-18(17)28-21/h4-12H,13H2,1-3H3