3-[4-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[4-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]-1,3-benzoxazol-2-one Openeye Name: 3-[4-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-4-oxo-butyl]-1,3-benzoxazol-2-one CAS Name: 3-[4-[4-(3,4-dichlorophenyl)sulfonyl-1-piperazinyl]-4-oxobutyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[4-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-4-oxobutyl]-1,3-benzoxazol-2-one Traditional Name: 3-[4-[4-(3,4-dichlorophenyl)sulfonylpiperazino]-4-keto-butyl]-1,3-benzoxazol-2-one Formula: C21H21Cl2N3O5S MolecularWeight: 498.37954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21Cl2N3O5S/c22-16-8-7-15(14-17(16)23)32(29,30)25-12-10-24(11-13-25)20(27)6-3-9-26-18-4-1-2-5-19(18)31-21(26)28/h1-2,4-5,7-8,14H,3,6,9-13H2