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

Systemtic Name: N-methyl-1-[4-(5-methyl-3-nitro-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]ethanamine Openeye Name: 1-[4-(2-benzyloxy-5-methyl-3-nitro-phenyl)thiazol-2-yl]-N-methyl-ethanamine CAS Name: N-methyl-1-[4-(5-methyl-3-nitro-2-phenylmethoxyphenyl)-2-thiazolyl]ethanamine IUPAC Name: N-methyl-1-[4-(5-methyl-3-nitro-2-phenylmethoxyphenyl)-1,3-thiazol-2-yl]ethanamine Traditional Name: 1-[4-(2-benzoxy-5-methyl-3-nitro-phenyl)thiazol-2-yl]ethyl-methyl-amine Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2=CSC(=N2)C(C)NC)OCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)C2=CSC(=N2)C(C)NC)OCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O3S/c1-13-9-16(17-12-27-20(22-17)14(2)21-3)19(18(10-13)23(24)25)26-11-15-7-5-4-6-8-15/h4-10,12,14,21H,11H2,1-3H3