N-[4-[2-oxidanylidene-2-(2-pyrrol-1-ylethylamino)ethyl]-1,3-thiazol-2-yl]pyrazine-2-carboxamide

Systemtic Name: N-[4-[2-oxidanylidene-2-(2-pyrrol-1-ylethylamino)ethyl]-1,3-thiazol-2-yl]pyrazine-2-carboxamide Openeye Name: N-[4-[2-oxo-2-(2-pyrrol-1-ylethylamino)ethyl]thiazol-2-yl]pyrazine-2-carboxamide CAS Name: N-[4-[2-oxo-2-[2-(1-pyrrolyl)ethylamino]ethyl]-2-thiazolyl]-2-pyrazinecarboxamide IUPAC Name: N-[4-[2-oxo-2-(2-pyrrol-1-ylethylamino)ethyl]-1,3-thiazol-2-yl]pyrazine-2-carboxamide Traditional Name: N-[4-[2-keto-2-(2-pyrrol-1-ylethylamino)ethyl]thiazol-2-yl]pyrazinamide Formula: C16H16N6O2S MolecularWeight: 356.40224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)CCNC(=O)CC2=CSC(=N2)NC(=O)C3=NC=CN=C3

Isomeric SMILES

C1=CN(C=C1)CCNC(=O)CC2=CSC(=N2)NC(=O)C3=NC=CN=C3

InChI

InChI=1S/C16H16N6O2S/c23-14(19-5-8-22-6-1-2-7-22)9-12-11-25-16(20-12)21-15(24)13-10-17-3-4-18-13/h1-4,6-7,10-11H,5,8-9H2,(H,19,23)(H,20,21,24)