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

Systemtic Name: N-methyl-2-[4-(5-methyl-3-nitro-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]ethanamine Openeye Name: 2-[4-(2-benzyloxy-5-methyl-3-nitro-phenyl)thiazol-2-yl]-N-methyl-ethanamine CAS Name: N-methyl-2-[4-(5-methyl-3-nitro-2-phenylmethoxyphenyl)-2-thiazolyl]ethanamine IUPAC Name: N-methyl-2-[4-(5-methyl-3-nitro-2-phenylmethoxyphenyl)-1,3-thiazol-2-yl]ethanamine Traditional Name: 2-[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)CCNC)OCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O3S/c1-14-10-16(17-13-27-19(22-17)8-9-21-2)20(18(11-14)23(24)25)26-12-15-6-4-3-5-7-15/h3-7,10-11,13,21H,8-9,12H2,1-2H3