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

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(tert-butylamino)-2-oxo-ethyl]pyrazine-2-carboxamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(tert-butylamino)-2-oxoethyl]-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(tert-butylamino)-2-oxoethyl]pyrazine-2-carboxamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(tert-butylamino)-2-keto-ethyl]pyrazinamide Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CNC(=O)C1=NC=CN=C1C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)NC(=O)CNC(=O)C1=NC=CN=C1C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H19N5O2S/c1-18(2,3)23-13(24)10-21-16(25)14-15(20-9-8-19-14)17-22-11-6-4-5-7-12(11)26-17/h4-9H,10H2,1-3H3,(H,21,25)(H,23,24)