N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]pyrazine-2-carboxamide

Systemtic Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]pyrazine-2-carboxamide Openeye Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]thiazol-2-yl]pyrazine-2-carboxamide CAS Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2-thiazolyl]-2-pyrazinecarboxamide IUPAC Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-1,3-thiazol-2-yl]pyrazine-2-carboxamide Traditional Name: N-[4-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thiazol-2-yl]pyrazinamide Formula: C17H13N5O4S MolecularWeight: 383.38122

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CC3=CSC(=N3)NC(=O)C4=NC=CN=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CC3=CSC(=N3)NC(=O)C4=NC=CN=C4

InChI

InChI=1S/C17H13N5O4S/c23-15(20-10-1-2-13-14(5-10)26-9-25-13)6-11-8-27-17(21-11)22-16(24)12-7-18-3-4-19-12/h1-5,7-8H,6,9H2,(H,20,23)(H,21,22,24)