N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamine

Systemtic Name: N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamine Openeye Name: N-[[5-(4-chlorophenyl)-2-furyl]methyl]-2-(1-phenyltetrazol-5-yl)sulfanyl-ethanamine CAS Name: N-[[5-(4-chlorophenyl)-2-furanyl]methyl]-2-[(1-phenyl-5-tetrazolyl)thio]ethanamine IUPAC Name: N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-2-(1-phenyltetrazol-5-yl)sulfanylethanamine Traditional Name: [5-(4-chlorophenyl)-2-furyl]methyl-[2-[(1-phenyltetrazol-5-yl)thio]ethyl]amine Formula: C20H18ClN5OS MolecularWeight: 411.90782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCCNCC3=CC=C(O3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCCNCC3=CC=C(O3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H18ClN5OS/c21-16-8-6-15(7-9-16)19-11-10-18(27-19)14-22-12-13-28-20-23-24-25-26(20)17-4-2-1-3-5-17/h1-11,22H,12-14H2