1-[2-(2-hydroxyethyloxy)ethyl]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea

Systemtic Name: 1-[2-(2-hydroxyethyloxy)ethyl]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-[2-(2-hydroxyethoxy)ethyl]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-[2-(2-hydroxyethoxy)ethyl]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-[2-(2-hydroxyethoxy)ethyl]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-[2-(2-hydroxyethoxy)ethyl]-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea Formula: C12H14N4O4S2 MolecularWeight: 342.39396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O4S2/c17-4-6-20-5-3-13-11(21)15-12-14-9-2-1-8(16(18)19)7-10(9)22-12/h1-2,7,17H,3-6H2,(H2,13,14,15,21)