1-(2-methyl-1,3-benzothiazol-6-yl)-3-(4-nitrophenyl)urea

Systemtic Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-(4-nitrophenyl)urea Openeye Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-(4-nitrophenyl)urea CAS Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-(4-nitrophenyl)urea IUPAC Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-(4-nitrophenyl)urea Traditional Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-(4-nitrophenyl)urea Formula: C15H12N4O3S MolecularWeight: 328.34578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O3S/c1-9-16-13-7-4-11(8-14(13)23-9)18-15(20)17-10-2-5-12(6-3-10)19(21)22/h2-8H,1H3,(H2,17,18,20)