[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylphenyl)methanone

Systemtic Name: [4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylphenyl)methanone Openeye Name: [4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylphenyl)methanone CAS Name: [4-[(3-methyl-5-isoxazolyl)methyl]-1-piperazinyl]-[3-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: [4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: [4-[(3-methylisoxazol-5-yl)methyl]piperazino]-(3-pyrrolidinosulfonylphenyl)methanone Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CN2CCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=NOC(=C1)CN2CCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H26N4O4S/c1-16-13-18(28-21-16)15-22-9-11-23(12-10-22)20(25)17-5-4-6-19(14-17)29(26,27)24-7-2-3-8-24/h4-6,13-14H,2-3,7-12,15H2,1H3