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

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(isopropylamino)-2-oxo-ethyl]pyrazine-2-carboxamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyrazine-2-carboxamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(isopropylamino)-2-keto-ethyl]pyrazinamide Formula: C17H17N5O2S MolecularWeight: 355.41418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N5O2S/c1-10(2)21-13(23)9-20-16(24)14-15(19-8-7-18-14)17-22-11-5-3-4-6-12(11)25-17/h3-8,10H,9H2,1-2H3,(H,20,24)(H,21,23)