1-morpholin-4-yl-3-(6-nitro-1,3-benzothiazol-2-yl)urea

Systemtic Name: 1-morpholin-4-yl-3-(6-nitro-1,3-benzothiazol-2-yl)urea Openeye Name: 1-morpholino-3-(6-nitro-1,3-benzothiazol-2-yl)urea CAS Name: 1-(4-morpholinyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea IUPAC Name: 1-morpholin-4-yl-3-(6-nitro-1,3-benzothiazol-2-yl)urea Traditional Name: 1-morpholino-3-(6-nitro-1,3-benzothiazol-2-yl)urea Formula: C12H13N5O4S MolecularWeight: 323.32772

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1NC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1NC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O4S/c18-11(15-16-3-5-21-6-4-16)14-12-13-9-2-1-8(17(19)20)7-10(9)22-12/h1-2,7H,3-6H2,(H2,13,14,15,18)