3-[4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butyl]-1,3-benzoxazol-2-one Openeye Name: 3-[4-[4-(benzenesulfonyl)piperazin-1-yl]-4-oxo-butyl]-1,3-benzoxazol-2-one CAS Name: 3-[4-[4-(benzenesulfonyl)-1-piperazinyl]-4-oxobutyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[4-[4-(benzenesulfonyl)piperazin-1-yl]-4-oxobutyl]-1,3-benzoxazol-2-one Traditional Name: 3-[4-(4-besylpiperazino)-4-keto-butyl]-1,3-benzoxazol-2-one Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCN2C3=CC=CC=C3OC2=O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CCCN2C3=CC=CC=C3OC2=O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O5S/c25-20(11-6-12-24-18-9-4-5-10-19(18)29-21(24)26)22-13-15-23(16-14-22)30(27,28)17-7-2-1-3-8-17/h1-5,7-10H,6,11-16H2