N-cycloheptyl-5-cyclohexyl-3-methyl-6-oxidanylidene-1-phenyl-4H-pyrazolo[4,3-f][1,4]thiazepine-4-carboxamide

Systemtic Name: N-cycloheptyl-5-cyclohexyl-3-methyl-6-oxidanylidene-1-phenyl-4H-pyrazolo[4,3-f][1,4]thiazepine-4-carboxamide Openeye Name: N-cycloheptyl-5-cyclohexyl-3-methyl-6-oxo-1-phenyl-4H-pyrazolo[4,3-f][1,4]thiazepine-4-carboxamide CAS Name: N-cycloheptyl-5-cyclohexyl-3-methyl-6-oxo-1-phenyl-4H-pyrazolo[4,3-f][1,4]thiazepine-4-carboxamide IUPAC Name: N-cycloheptyl-5-cyclohexyl-3-methyl-6-oxo-1-phenyl-4H-pyrazolo[4,3-f][1,4]thiazepine-4-carboxamide Traditional Name: N-cycloheptyl-5-cyclohexyl-6-keto-3-methyl-1-phenyl-4H-pyrazolo[4,3-f][1,4]thiazepine-4-carboxamide Formula: C27H36N4O2S MolecularWeight: 480.66534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(N(C(=O)CS2)C3CCCCC3)C(=O)NC4CCCCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=C1C(N(C(=O)CS2)C3CCCCC3)C(=O)NC4CCCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C27H36N4O2S/c1-19-24-25(26(33)28-20-12-6-2-3-7-13-20)30(21-14-8-4-9-15-21)23(32)18-34-27(24)31(29-19)22-16-10-5-11-17-22/h5,10-11,16-17,20-21,25H,2-4,6-9,12-15,18H2,1H3,(H,28,33)