1-(3-methylphenyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea

Systemtic Name: 1-(3-methylphenyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea Openeye Name: 1-(m-tolyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea CAS Name: 1-(3-methylphenyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea IUPAC Name: 1-(3-methylphenyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea Traditional Name: 1-(m-tolyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea Formula: C15H12N4O3S MolecularWeight: 328.34578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

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