N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-4-methoxy-1-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-4-methoxy-1-phenyl-pyrazole-3-carboxamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-4-methoxy-1-phenyl-pyrazole-3-carboxamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-4-methoxy-1-phenyl-3-pyrazolecarboxamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-4-methoxy-1-phenylpyrazole-3-carboxamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-4-methoxy-1-phenyl-pyrazole-3-carboxamide Formula: C17H17N5O3S2 MolecularWeight: 403.47858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=NN(C=C2OC)C3=CC=CC=C3)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=NN(C=C2OC)C3=CC=CC=C3)SCC(=O)N

InChI

InChI=1S/C17H17N5O3S2/c1-10-16(26-9-13(18)23)27-17(19-10)20-15(24)14-12(25-2)8-22(21-14)11-6-4-3-5-7-11/h3-8H,9H2,1-2H3,(H2,18,23)(H,19,20,24)