N-[4-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-1,3-thiazol-2-yl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[4-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-1,3-thiazol-2-yl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[4-(2,5-dimethyl-1-propyl-pyrrol-3-yl)thiazol-2-yl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[4-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-thiazolyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[4-(2,5-dimethyl-1-propylpyrrol-3-yl)-1,3-thiazol-2-yl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[4-(2,5-dimethyl-1-propyl-pyrrol-3-yl)thiazol-2-yl]-2-(2-nitrophenoxy)acetamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C2=CSC(=N2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CCCN1C(=CC(=C1C)C2=CSC(=N2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C20H22N4O4S/c1-4-9-23-13(2)10-15(14(23)3)16-12-29-20(21-16)22-19(25)11-28-18-8-6-5-7-17(18)24(26)27/h5-8,10,12H,4,9,11H2,1-3H3,(H,21,22,25)