2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(thiophen-3-ylmethyl)ethanamine

Systemtic Name: 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(thiophen-3-ylmethyl)ethanamine Openeye Name: 2-(1-phenyltetrazol-5-yl)sulfanyl-N-(3-thienylmethyl)ethanamine CAS Name: 2-[(1-phenyl-5-tetrazolyl)thio]-N-(3-thiophenylmethyl)ethanamine IUPAC Name: 2-(1-phenyltetrazol-5-yl)sulfanyl-N-(thiophen-3-ylmethyl)ethanamine Traditional Name: 2-[(1-phenyltetrazol-5-yl)thio]ethyl-(3-thenyl)amine Formula: C14H15N5S2 MolecularWeight: 317.4324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCCNCC3=CSC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCCNCC3=CSC=C3

InChI

InChI=1S/C14H15N5S2/c1-2-4-13(5-3-1)19-14(16-17-18-19)21-9-7-15-10-12-6-8-20-11-12/h1-6,8,11,15H,7,9-10H2