1-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-3-(2-methylpropyl)thiourea

Systemtic Name: 1-[3-(4-chloranylphenoxy)-5-nitro-phenyl]-3-(2-methylpropyl)thiourea Openeye Name: 1-[3-(4-chlorophenoxy)-5-nitro-phenyl]-3-isobutyl-thiourea CAS Name: 1-[3-(4-chlorophenoxy)-5-nitrophenyl]-3-(2-methylpropyl)thiourea IUPAC Name: 1-[3-(4-chlorophenoxy)-5-nitrophenyl]-3-(2-methylpropyl)thiourea Traditional Name: 1-[3-(4-chlorophenoxy)-5-nitro-phenyl]-3-isobutyl-thiourea Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=S)NC1=CC(=CC(=C1)OC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC(=S)NC1=CC(=CC(=C1)OC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H18ClN3O3S/c1-11(2)10-19-17(25)20-13-7-14(21(22)23)9-16(8-13)24-15-5-3-12(18)4-6-15/h3-9,11H,10H2,1-2H3,(H2,19,20,25)