1-(4-nitrophenyl)-3-(2-thiophen-2-ylethyl)thiourea

Systemtic Name: 1-(4-nitrophenyl)-3-(2-thiophen-2-ylethyl)thiourea Openeye Name: 1-(4-nitrophenyl)-3-[2-(2-thienyl)ethyl]thiourea CAS Name: 1-(4-nitrophenyl)-3-(2-thiophen-2-ylethyl)thiourea IUPAC Name: 1-(4-nitrophenyl)-3-(2-thiophen-2-ylethyl)thiourea Traditional Name: 1-(4-nitrophenyl)-3-[2-(2-thienyl)ethyl]thiourea Formula: C13H13N3O2S2 MolecularWeight: 307.39122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)CCNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O2S2/c17-16(18)11-5-3-10(4-6-11)15-13(19)14-8-7-12-2-1-9-20-12/h1-6,9H,7-8H2,(H2,14,15,19)