1-[2-[(1-naphthalen-1-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]-3-(2-nitrophenyl)urea

Systemtic Name: 1-[2-[(1-naphthalen-1-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]-3-(2-nitrophenyl)urea Openeye Name: 1-[2-[1-(1-naphthyl)tetrazol-5-yl]sulfanylethyl]-3-(2-nitrophenyl)urea CAS Name: 1-[2-[[1-(1-naphthalenyl)-5-tetrazolyl]thio]ethyl]-3-(2-nitrophenyl)urea IUPAC Name: 1-[2-(1-naphthalen-1-yltetrazol-5-yl)sulfanylethyl]-3-(2-nitrophenyl)urea Traditional Name: 1-[2-[[1-(1-naphthyl)tetrazol-5-yl]thio]ethyl]-3-(2-nitrophenyl)urea Formula: C20H17N7O3S MolecularWeight: 435.45908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2N3C(=NN=N3)SCCNC(=O)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N3C(=NN=N3)SCCNC(=O)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H17N7O3S/c28-19(22-16-9-3-4-10-18(16)27(29)30)21-12-13-31-20-23-24-25-26(20)17-11-5-7-14-6-1-2-8-15(14)17/h1-11H,12-13H2,(H2,21,22,28)