N-[[2-methoxy-5-(1,2,3-thiadiazol-5-ylsulfonyl)phenyl]methyl]-2-phenyl-piperidin-3-amine

Systemtic Name: N-[[2-methoxy-5-(1,2,3-thiadiazol-5-ylsulfonyl)phenyl]methyl]-2-phenyl-piperidin-3-amine Openeye Name: N-[[2-methoxy-5-(thiadiazol-5-ylsulfonyl)phenyl]methyl]-2-phenyl-piperidin-3-amine CAS Name: N-[[2-methoxy-5-(5-thiadiazolylsulfonyl)phenyl]methyl]-2-phenyl-3-piperidinamine IUPAC Name: N-[[2-methoxy-5-(thiadiazol-5-ylsulfonyl)phenyl]methyl]-2-phenylpiperidin-3-amine Traditional Name: [2-methoxy-5-(thiadiazol-5-ylsulfonyl)benzyl]-(2-phenyl-3-piperidyl)amine Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)C2=CN=NS2)CNC3CCCNC3C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)C2=CN=NS2)CNC3CCCNC3C4=CC=CC=C4

InChI

InChI=1S/C21H24N4O3S2/c1-28-19-10-9-17(30(26,27)20-14-24-25-29-20)12-16(19)13-23-18-8-5-11-22-21(18)15-6-3-2-4-7-15/h2-4,6-7,9-10,12,14,18,21-23H,5,8,11,13H2,1H3