1-ethyl-5-methyl-3-(7-methyl-6-nitro-1,3-benzothiazol-2-yl)-1,3,5-triazinan-2-one

Systemtic Name: 1-ethyl-5-methyl-3-(7-methyl-6-nitro-1,3-benzothiazol-2-yl)-1,3,5-triazinan-2-one Openeye Name: 1-ethyl-5-methyl-3-(7-methyl-6-nitro-1,3-benzothiazol-2-yl)-1,3,5-triazinan-2-one CAS Name: 1-ethyl-5-methyl-3-(7-methyl-6-nitro-1,3-benzothiazol-2-yl)-1,3,5-triazinan-2-one IUPAC Name: 1-ethyl-5-methyl-3-(7-methyl-6-nitro-1,3-benzothiazol-2-yl)-1,3,5-triazinan-2-one Traditional Name: 1-ethyl-5-methyl-3-(7-methyl-6-nitro-1,3-benzothiazol-2-yl)-1,3,5-triazinan-2-one Formula: C14H17N5O3S MolecularWeight: 335.38148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CN(CN(C1=O)C2=NC3=C(S2)C(=C(C=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CCN1CN(CN(C1=O)C2=NC3=C(S2)C(=C(C=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C14H17N5O3S/c1-4-17-7-16(3)8-18(14(17)20)13-15-10-5-6-11(19(21)22)9(2)12(10)23-13/h5-6H,4,7-8H2,1-3H3