N-[[3-(1-methanoyl-2,3,4,5-tetrahydro-1-benzazepin-7-yl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]ethanethioamide

Systemtic Name: N-[[3-(1-methanoyl-2,3,4,5-tetrahydro-1-benzazepin-7-yl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl]ethanethioamide Openeye Name: N-[[3-(1-formyl-2,3,4,5-tetrahydro-1-benzazepin-7-yl)-2-oxo-oxazolidin-5-yl]methyl]thioacetamide CAS Name: N-[[3-(1-formyl-2,3,4,5-tetrahydro-1-benzazepin-7-yl)-2-oxo-5-oxazolidinyl]methyl]ethanethioamide IUPAC Name: N-[[3-(1-formyl-2,3,4,5-tetrahydro-1-benzazepin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]ethanethioamide Traditional Name: N-[[3-(1-formyl-2,3,4,5-tetrahydro-1-benzazepin-7-yl)-2-keto-oxazolidin-5-yl]methyl]thioacetamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NCC1CN(C(=O)O1)C2=CC3=C(C=C2)N(CCCC3)C=O

Isomeric SMILES

CC(=S)NCC1CN(C(=O)O1)C2=CC3=C(C=C2)N(CCCC3)C=O

InChI

InChI=1S/C17H21N3O3S/c1-12(24)18-9-15-10-20(17(22)23-15)14-5-6-16-13(8-14)4-2-3-7-19(16)11-21/h5-6,8,11,15H,2-4,7,9-10H2,1H3,(H,18,24)