N-[3,5-bis(chloranyl)phenyl]methanamide; 1-(4-but-2-ynoxyphenyl)sulfonyl-4-oxidanyl-piperazine-2-carboxamide

Systemtic Name: N-[3,5-bis(chloranyl)phenyl]methanamide; 1-(4-but-2-ynoxyphenyl)sulfonyl-4-oxidanyl-piperazine-2-carboxamide Openeye Name: 1-(4-but-2-ynoxyphenyl)sulfonyl-4-hydroxy-piperazine-2-carboxamide; N-(3,5-dichlorophenyl)formamide CAS Name: 1-(4-but-2-ynoxyphenyl)sulfonyl-4-hydroxy-2-piperazinecarboxamide; N-(3,5-dichlorophenyl)formamide IUPAC Name: 1-(4-but-2-ynoxyphenyl)sulfonyl-4-hydroxypiperazine-2-carboxamide; N-(3,5-dichlorophenyl)formamide Traditional Name: 1-(4-but-2-ynoxyphenyl)sulfonyl-4-hydroxy-piperazine-2-carboxamide; N-(3,5-dichlorophenyl)formamide Formula: C22H24Cl2N4O6S MolecularWeight: 543.42016

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)N)O.C1=C(C=C(C=C1Cl)Cl)NC=O

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)N)O.C1=C(C=C(C=C1Cl)Cl)NC=O

InChI

InChI=1S/C15H19N3O5S.C7H5Cl2NO/c1-2-3-10-23-12-4-6-13(7-5-12)24(21,22)18-9-8-17(20)11-14(18)15(16)19;8-5-1-6(9)3-7(2-5)10-4-11/h4-7,14,20H,8-11H2,1H3,(H2,16,19);1-4H,(H,10,11)