N-(4-piperidin-1-ylsulfonylphenyl)-2-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide

Systemtic Name: N-(4-piperidin-1-ylsulfonylphenyl)-2-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide Openeye Name: 2-(1-isopropyltetrazol-5-yl)sulfanyl-N-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: N-[4-(1-piperidinylsulfonyl)phenyl]-2-[(1-propan-2-yl-5-tetrazolyl)thio]propanamide IUPAC Name: N-(4-piperidin-1-ylsulfonylphenyl)-2-(1-propan-2-yltetrazol-5-yl)sulfanylpropanamide Traditional Name: 2-[(1-isopropyltetrazol-5-yl)thio]-N-(4-piperidinosulfonylphenyl)propionamide Formula: C18H26N6O3S2 MolecularWeight: 438.56744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=N1)SC(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)N1C(=NN=N1)SC(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H26N6O3S2/c1-13(2)24-18(20-21-22-24)28-14(3)17(25)19-15-7-9-16(10-8-15)29(26,27)23-11-5-4-6-12-23/h7-10,13-14H,4-6,11-12H2,1-3H3,(H,19,25)