N-cyclooctyl-3-methyl-4-[(4-methylphenyl)methyl]-5-oxidanylidene-7-phenyl-2H-thieno[2,3-f][1,4]oxazepine-3-carboxamide

Systemtic Name: N-cyclooctyl-3-methyl-4-[(4-methylphenyl)methyl]-5-oxidanylidene-7-phenyl-2H-thieno[2,3-f][1,4]oxazepine-3-carboxamide Openeye Name: N-cyclooctyl-3-methyl-5-oxo-7-phenyl-4-(p-tolylmethyl)-2H-thieno[2,3-f][1,4]oxazepine-3-carboxamide CAS Name: N-cyclooctyl-3-methyl-4-[(4-methylphenyl)methyl]-5-oxo-7-phenyl-2H-thieno[2,3-f][1,4]oxazepine-3-carboxamide IUPAC Name: N-cyclooctyl-3-methyl-4-[(4-methylphenyl)methyl]-5-oxo-7-phenyl-2H-thieno[2,3-f][1,4]oxazepine-3-carboxamide Traditional Name: N-cyclooctyl-5-keto-3-methyl-4-(4-methylbenzyl)-7-phenyl-2H-thieno[2,3-f][1,4]oxazepine-3-carboxamide Formula: C31H36N2O3S MolecularWeight: 516.69414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=C(C=C(S3)C4=CC=CC=C4)OCC2(C)C(=O)NC5CCCCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=C(C=C(S3)C4=CC=CC=C4)OCC2(C)C(=O)NC5CCCCCCC5

InChI

InChI=1S/C31H36N2O3S/c1-22-15-17-23(18-16-22)20-33-29(34)28-26(19-27(37-28)24-11-7-6-8-12-24)36-21-31(33,2)30(35)32-25-13-9-4-3-5-10-14-25/h6-8,11-12,15-19,25H,3-5,9-10,13-14,20-21H2,1-2H3,(H,32,35)