methanamine; 2-[[2-methyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-imidazol-1-yl]methyl]pyridine

Systemtic Name: methanamine; 2-[[2-methyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-imidazol-1-yl]methyl]pyridine Openeye Name: 2-[[4-isopropyl-2-methyl-5-(3-nitrophenyl)sulfanyl-imidazol-1-yl]methyl]pyridine; methanamine CAS Name: methanamine; 2-[[2-methyl-5-[(3-nitrophenyl)thio]-4-propan-2-yl-1-imidazolyl]methyl]pyridine IUPAC Name: methanamine; 2-[[2-methyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-ylimidazol-1-yl]methyl]pyridine Traditional Name: 2-[[4-isopropyl-2-methyl-5-[(3-nitrophenyl)thio]imidazol-1-yl]methyl]pyridine; methylamine Formula: C20H25N5O2S MolecularWeight: 399.5098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1CC2=CC=CC=N2)SC3=CC=CC(=C3)[N+](=O)[O-])C(C)C.CN

Isomeric SMILES

CC1=NC(=C(N1CC2=CC=CC=N2)SC3=CC=CC(=C3)[N+](=O)[O-])C(C)C.CN

InChI

InChI=1S/C19H20N4O2S.CH5N/c1-13(2)18-19(26-17-9-6-8-16(11-17)23(24)25)22(14(3)21-18)12-15-7-4-5-10-20-15;1-2/h4-11,13H,12H2,1-3H3;2H2,1H3