1-(3-chloranyl-4-methyl-phenyl)-3-[(3-nitrophenyl)sulfonylamino]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[(3-nitrophenyl)sulfonylamino]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[(3-nitrophenyl)sulfonylamino]thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[(3-nitrophenyl)sulfonylamino]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[(3-nitrophenyl)sulfonylamino]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[(3-nitrophenyl)sulfonylamino]thiourea Formula: C14H13ClN4O4S2 MolecularWeight: 400.86042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H13ClN4O4S2/c1-9-5-6-10(7-13(9)15)16-14(24)17-18-25(22,23)12-4-2-3-11(8-12)19(20)21/h2-8,18H,1H3,(H2,16,17,24)