1-(5-chloranyl-2-methyl-phenyl)-3-[(3-chloranyl-6-nitro-1-benzothiophen-2-yl)carbonylamino]thiourea

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-3-[(3-chloranyl-6-nitro-1-benzothiophen-2-yl)carbonylamino]thiourea Openeye Name: 1-(5-chloro-2-methyl-phenyl)-3-[(3-chloro-6-nitro-benzothiophene-2-carbonyl)amino]thiourea CAS Name: 1-(5-chloro-2-methylphenyl)-3-[[(3-chloro-6-nitro-1-benzothiophen-2-yl)-oxomethyl]amino]thiourea IUPAC Name: 1-(5-chloro-2-methylphenyl)-3-[(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)amino]thiourea Traditional Name: 1-(5-chloro-2-methyl-phenyl)-3-[(3-chloro-6-nitro-benzothiophene-2-carbonyl)amino]thiourea Formula: C17H12Cl2N4O3S2 MolecularWeight: 455.33818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=S)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=S)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H12Cl2N4O3S2/c1-8-2-3-9(18)6-12(8)20-17(27)22-21-16(24)15-14(19)11-5-4-10(23(25)26)7-13(11)28-15/h2-7H,1H3,(H,21,24)(H2,20,22,27)