1-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(3-nitrophenyl)urea

Systemtic Name: 1-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(3-nitrophenyl)urea Openeye Name: 1-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(3-nitrophenyl)urea CAS Name: 1-[2-[(2-cyanophenyl)methylthio]ethyl]-3-(3-nitrophenyl)urea IUPAC Name: 1-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(3-nitrophenyl)urea Traditional Name: 1-[2-[(2-cyanobenzyl)thio]ethyl]-3-(3-nitrophenyl)urea Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H16N4O3S/c18-11-13-4-1-2-5-14(13)12-25-9-8-19-17(22)20-15-6-3-7-16(10-15)21(23)24/h1-7,10H,8-9,12H2,(H2,19,20,22)