N-[[1-(1-benzothiophen-2-ylsulfonyl)piperidin-3-yl]methyl]-5-methyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[[1-(1-benzothiophen-2-ylsulfonyl)piperidin-3-yl]methyl]-5-methyl-1,2-oxazole-3-carboxamide Openeye Name: N-[[1-(benzothiophen-2-ylsulfonyl)-3-piperidyl]methyl]-5-methyl-isoxazole-3-carboxamide CAS Name: N-[[1-(1-benzothiophen-2-ylsulfonyl)-3-piperidinyl]methyl]-5-methyl-3-isoxazolecarboxamide IUPAC Name: N-[[1-(1-benzothiophen-2-ylsulfonyl)piperidin-3-yl]methyl]-5-methyl-1,2-oxazole-3-carboxamide Traditional Name: N-[[1-(benzothiophen-2-ylsulfonyl)-3-piperidyl]methyl]-5-methyl-isoxazole-3-carboxamide Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)NCC2CCCN(C2)S(=O)(=O)C3=CC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=NO1)C(=O)NCC2CCCN(C2)S(=O)(=O)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C19H21N3O4S2/c1-13-9-16(21-26-13)19(23)20-11-14-5-4-8-22(12-14)28(24,25)18-10-15-6-2-3-7-17(15)27-18/h2-3,6-7,9-10,14H,4-5,8,11-12H2,1H3,(H,20,23)