N-[4-(azepan-1-yl)phenyl]-3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-3-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]propanamide CAS Name: N-[4-(1-azepanyl)phenyl]-3-[(3,5-dimethyl-4-isoxazolyl)sulfonylamino]propanamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-3-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]propionamide Formula: C20H28N4O4S MolecularWeight: 420.52572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NCCC(=O)NC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)NCCC(=O)NC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C20H28N4O4S/c1-15-20(16(2)28-23-15)29(26,27)21-12-11-19(25)22-17-7-9-18(10-8-17)24-13-5-3-4-6-14-24/h7-10,21H,3-6,11-14H2,1-2H3,(H,22,25)