5-methyl-3-phenyl-N'-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonyl)-1,2-oxazole-4-carbohydrazide

Systemtic Name: 5-methyl-3-phenyl-N'-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonyl)-1,2-oxazole-4-carbohydrazide Openeye Name: 5-methyl-3-phenyl-N'-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonyl)isoxazole-4-carbohydrazide CAS Name: 5-methyl-N'-[oxo(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]-3-phenyl-4-isoxazolecarbohydrazide IUPAC Name: 5-methyl-3-phenyl-N'-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonyl)-1,2-oxazole-4-carbohydrazide Traditional Name: 5-methyl-3-phenyl-N'-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonyl)isoxazole-4-carbohydrazide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NNC(=O)C3=CC4=C(S3)CCCCC4

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NNC(=O)C3=CC4=C(S3)CCCCC4

InChI

InChI=1S/C21H21N3O3S/c1-13-18(19(24-27-13)14-8-4-2-5-9-14)21(26)23-22-20(25)17-12-15-10-6-3-7-11-16(15)28-17/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3,(H,22,25)(H,23,26)