N-[(E)-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]methylideneamino]-2-(2-methylphenoxy)ethanamide

Systemtic Name: N-[(E)-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]methylideneamino]-2-(2-methylphenoxy)ethanamide Openeye Name: N-[(E)-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitro-phenyl]methyleneamino]-2-(2-methylphenoxy)acetamide CAS Name: N-[(E)-[4-[(1-methyl-2-imidazolyl)thio]-3-nitrophenyl]methylideneamino]-2-(2-methylphenoxy)acetamide IUPAC Name: N-[(E)-[4-(1-methylimidazol-2-yl)sulfanyl-3-nitrophenyl]methylideneamino]-2-(2-methylphenoxy)acetamide Traditional Name: N-[(E)-[4-[(1-methylimidazol-2-yl)thio]-3-nitro-benzylidene]amino]-2-(2-methylphenoxy)acetamide Formula: C20H19N5O4S MolecularWeight: 425.46096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NN=CC2=CC(=C(C=C2)SC3=NC=CN3C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)N/N=C/C2=CC(=C(C=C2)SC3=NC=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O4S/c1-14-5-3-4-6-17(14)29-13-19(26)23-22-12-15-7-8-18(16(11-15)25(27)28)30-20-21-9-10-24(20)2/h3-12H,13H2,1-2H3,(H,23,26)/b22-12+