1-[3-(dimethylamino)propyl]-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiourea

Systemtic Name: 1-[3-(dimethylamino)propyl]-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiourea Openeye Name: 1-[3-(dimethylamino)propyl]-3-[(E)-(5-nitro-2-furyl)methyleneamino]thiourea CAS Name: 1-[3-(dimethylamino)propyl]-3-[(E)-(5-nitro-2-furanyl)methylideneamino]thiourea IUPAC Name: 1-[3-(dimethylamino)propyl]-3-[(E)-(5-nitrofuran-2-yl)methylideneamino]thiourea Traditional Name: 1-[3-(dimethylamino)propyl]-3-[(E)-(5-nitro-2-furyl)methyleneamino]thiourea Formula: C11H17N5O3S MolecularWeight: 299.34938

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=S)NN=CC1=CC=C(O1)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCNC(=S)N/N=C/C1=CC=C(O1)[N+](=O)[O-]

InChI

InChI=1S/C11H17N5O3S/c1-15(2)7-3-6-12-11(20)14-13-8-9-4-5-10(19-9)16(17)18/h4-5,8H,3,6-7H2,1-2H3,(H2,12,14,20)/b13-8+