2-[[4-cycloheptyl-5-(3-morpholin-4-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[[4-cycloheptyl-5-(3-morpholin-4-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-N-propan-2-yl-ethanamide Openeye Name: 2-[[4-cycloheptyl-5-(3-morpholinosulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-isopropyl-N-phenyl-acetamide CAS Name: 2-[[4-cycloheptyl-5-[3-(4-morpholinylsulfonyl)phenyl]-1,2,4-triazol-3-yl]thio]-N-phenyl-N-propan-2-ylacetamide IUPAC Name: 2-[[4-cycloheptyl-5-(3-morpholin-4-ylsulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-N-propan-2-ylacetamide Traditional Name: 2-[[4-cycloheptyl-5-(3-morpholinosulfonylphenyl)-1,2,4-triazol-3-yl]thio]-N-isopropyl-N-phenyl-acetamide Formula: C30H39N5O4S2 MolecularWeight: 597.79176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)CSC2=NN=C(N2C3CCCCCC3)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)CSC2=NN=C(N2C3CCCCCC3)C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C30H39N5O4S2/c1-23(2)34(25-12-8-5-9-13-25)28(36)22-40-30-32-31-29(35(30)26-14-6-3-4-7-15-26)24-11-10-16-27(21-24)41(37,38)33-17-19-39-20-18-33/h5,8-13,16,21,23,26H,3-4,6-7,14-15,17-20,22H2,1-2H3