1-(3-chloranyl-2-methyl-phenyl)-3-[2-(2,5-dimethoxy-4-nitro-phenyl)sulfanylethanoylamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[2-(2,5-dimethoxy-4-nitro-phenyl)sulfanylethanoylamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[[2-(2,5-dimethoxy-4-nitro-phenyl)sulfanylacetyl]amino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[[2-[(2,5-dimethoxy-4-nitrophenyl)thio]-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[[2-(2,5-dimethoxy-4-nitrophenyl)sulfanylacetyl]amino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[[2-[(2,5-dimethoxy-4-nitro-phenyl)thio]acetyl]amino]thiourea Formula: C18H19ClN4O5S2 MolecularWeight: 470.95026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC(=O)CSC2=C(C=C(C(=C2)OC)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC(=O)CSC2=C(C=C(C(=C2)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C18H19ClN4O5S2/c1-10-11(19)5-4-6-12(10)20-18(29)22-21-17(24)9-30-16-8-14(27-2)13(23(25)26)7-15(16)28-3/h4-8H,9H2,1-3H3,(H,21,24)(H2,20,22,29)