[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,4-diazepan-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,4-diazepan-1-yl]-pyridin-4-yl-methanone Openeye Name: [4-(3,5-dimethylisoxazol-4-yl)sulfonyl-1,4-diazepan-1-yl]-(4-pyridyl)methanone CAS Name: [4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1,4-diazepan-1-yl]-pyridin-4-ylmethanone IUPAC Name: [4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,4-diazepan-1-yl]-pyridin-4-ylmethanone Traditional Name: [4-(3,5-dimethylisoxazol-4-yl)sulfonyl-1,4-diazepan-1-yl]-(4-pyridyl)methanone Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCN(CC2)C(=O)C3=CC=NC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCN(CC2)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C16H20N4O4S/c1-12-15(13(2)24-18-12)25(22,23)20-9-3-8-19(10-11-20)16(21)14-4-6-17-7-5-14/h4-7H,3,8-11H2,1-2H3