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

Systemtic Name: 1-(3-morpholin-4-ylpropyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-(3-morpholinopropyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-[3-(4-morpholinyl)propyl]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-(3-morpholin-4-ylpropyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-(3-morpholinopropyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea Formula: C15H19N5O3S2 MolecularWeight: 381.47306

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=S)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCCNC(=S)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H19N5O3S2/c21-20(22)11-2-3-12-13(10-11)25-15(17-12)18-14(24)16-4-1-5-19-6-8-23-9-7-19/h2-3,10H,1,4-9H2,(H2,16,17,18,24)