1-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[2-hydroxy-2-(4-nitrophenyl)ethyl]thiourea CAS Name: 1-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[2-hydroxy-2-(4-nitrophenyl)ethyl]thiourea Traditional Name: 1-benzyl-3-[2-hydroxy-2-(4-nitrophenyl)ethyl]thiourea Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C16H17N3O3S/c20-15(13-6-8-14(9-7-13)19(21)22)11-18-16(23)17-10-12-4-2-1-3-5-12/h1-9,15,20H,10-11H2,(H2,17,18,23)