1-[4-(5-methyl-3-nitro-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]pyrrole-2-carbaldehyde

Systemtic Name: 1-[4-(5-methyl-3-nitro-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]pyrrole-2-carbaldehyde Openeye Name: 1-[4-(2-benzyloxy-5-methyl-3-nitro-phenyl)thiazol-2-yl]pyrrole-2-carbaldehyde CAS Name: 1-[4-(5-methyl-3-nitro-2-phenylmethoxyphenyl)-2-thiazolyl]-2-pyrrolecarboxaldehyde IUPAC Name: 1-[4-(5-methyl-3-nitro-2-phenylmethoxyphenyl)-1,3-thiazol-2-yl]pyrrole-2-carbaldehyde Traditional Name: 1-[4-(2-benzoxy-5-methyl-3-nitro-phenyl)thiazol-2-yl]pyrrole-2-carbaldehyde Formula: C22H17N3O4S MolecularWeight: 419.45308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2=CSC(=N2)N3C=CC=C3C=O)OCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)C2=CSC(=N2)N3C=CC=C3C=O)OCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O4S/c1-15-10-18(19-14-30-22(23-19)24-9-5-8-17(24)12-26)21(20(11-15)25(27)28)29-13-16-6-3-2-4-7-16/h2-12,14H,13H2,1H3