(1S)-N-(furan-2-ylmethyl)-1-(1-phenethyl-1,2,3,4-tetrazol-5-yl)-1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine

Systemtic Name: (1S)-N-(furan-2-ylmethyl)-1-(1-phenethyl-1,2,3,4-tetrazol-5-yl)-1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine Openeye Name: (1S)-N-(2-furylmethyl)-1-(1-phenethyltetrazol-5-yl)-1-(2-pyridyl)-N-(2-thienylmethyl)methanamine CAS Name: (1S)-N-(2-furanylmethyl)-1-(1-phenethyl-5-tetrazolyl)-1-(2-pyridinyl)-N-(thiophen-2-ylmethyl)methanamine IUPAC Name: (1S)-N-(furan-2-ylmethyl)-1-(1-phenethyltetrazol-5-yl)-1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine Traditional Name: 2-furfuryl-[(S)-(1-phenethyltetrazol-5-yl)-(2-pyridyl)methyl]-(2-thenyl)amine Formula: C25H24N6OS MolecularWeight: 456.56266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NN=N2)C(C3=CC=CC=N3)N(CC4=CC=CO4)CC5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NN=N2)[C@H](C3=CC=CC=N3)N(CC4=CC=CO4)CC5=CC=CS5

InChI

InChI=1S/C25H24N6OS/c1-2-8-20(9-3-1)13-15-31-25(27-28-29-31)24(23-12-4-5-14-26-23)30(18-21-10-6-16-32-21)19-22-11-7-17-33-22/h1-12,14,16-17,24H,13,15,18-19H2/t24-/m0/s1