1-(3-nitrophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea

Systemtic Name: 1-(3-nitrophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-(3-nitrophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-(3-nitrophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-(3-nitrophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-(3-nitrophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea Formula: C14H14N4O2S2 MolecularWeight: 334.41656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O2S2/c19-18(20)10-5-3-4-9(8-10)15-13(21)17-14-16-11-6-1-2-7-12(11)22-14/h3-5,8H,1-2,6-7H2,(H2,15,16,17,21)