1-(2-azanylethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea

Systemtic Name: 1-(2-azanylethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea Openeye Name: 1-(2-aminoethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea CAS Name: 1-(2-aminoethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea IUPAC Name: 1-(2-aminoethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea Traditional Name: 1-(2-aminoethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea Formula: C10H11N5O3S MolecularWeight: 281.29104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)NCCN

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)NCCN

InChI

InChI=1S/C10H11N5O3S/c11-3-4-12-9(16)14-10-13-7-2-1-6(15(17)18)5-8(7)19-10/h1-2,5H,3-4,11H2,(H2,12,13,14,16)