N-(1-cyclopropylethyl)-4-nitro-1,3-benzothiazol-5-amine

Systemtic Name: N-(1-cyclopropylethyl)-4-nitro-1,3-benzothiazol-5-amine Openeye Name: N-(1-cyclopropylethyl)-4-nitro-1,3-benzothiazol-5-amine CAS Name: N-(1-cyclopropylethyl)-4-nitro-1,3-benzothiazol-5-amine IUPAC Name: N-(1-cyclopropylethyl)-4-nitro-1,3-benzothiazol-5-amine Traditional Name: 1-cyclopropylethyl-(4-nitro-1,3-benzothiazol-5-yl)amine Formula: C12H13N3O2S MolecularWeight: 263.31552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)NC2=C(C3=C(C=C2)SC=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C1CC1)NC2=C(C3=C(C=C2)SC=N3)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O2S/c1-7(8-2-3-8)14-9-4-5-10-11(13-6-18-10)12(9)15(16)17/h4-8,14H,2-3H2,1H3