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

Systemtic Name: 1-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-3-(thiophen-2-ylmethyl)thiourea Openeye Name: 1-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3-(2-thienylmethyl)thiourea CAS Name: 1-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3-(thiophen-2-ylmethyl)thiourea IUPAC Name: 1-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3-(thiophen-2-ylmethyl)thiourea Traditional Name: 1-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3-(2-thenyl)thiourea Formula: C14H15N3O3S2 MolecularWeight: 337.4172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O3S2/c18-13(10-3-5-11(6-4-10)17(19)20)9-16-14(21)15-8-12-2-1-7-22-12/h1-7,13,18H,8-9H2,(H2,15,16,21)