1-[2-(3-chlorophenyl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-[2-(3-chlorophenyl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-[2-(3-chlorophenyl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-[2-(3-chlorophenyl)ethyl]-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-[2-(3-chlorophenyl)ethyl]-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-[2-(3-chlorophenyl)ethyl]-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C16H16ClN3O3S MolecularWeight: 365.83454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NCCC2=CC(=CC=C2)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NCCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C16H16ClN3O3S/c1-23-15-10-13(20(21)22)5-6-14(15)19-16(24)18-8-7-11-3-2-4-12(17)9-11/h2-6,9-10H,7-8H2,1H3,(H2,18,19,24)