N,N-diethyl-4-(2-phenylazanylphenyl)carbonyl-piperazine-1-sulfonamide

Systemtic Name: N,N-diethyl-4-(2-phenylazanylphenyl)carbonyl-piperazine-1-sulfonamide Openeye Name: 4-(2-anilinobenzoyl)-N,N-diethyl-piperazine-1-sulfonamide CAS Name: 4-[(2-anilinophenyl)-oxomethyl]-N,N-diethyl-1-piperazinesulfonamide IUPAC Name: 4-(2-anilinobenzoyl)-N,N-diethylpiperazine-1-sulfonamide Traditional Name: 4-(2-anilinobenzoyl)-N,N-diethyl-piperazine-1-sulfonamide Formula: C21H28N4O3S MolecularWeight: 416.53702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC3=CC=CC=C3

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC3=CC=CC=C3

InChI

InChI=1S/C21H28N4O3S/c1-3-24(4-2)29(27,28)25-16-14-23(15-17-25)21(26)19-12-8-9-13-20(19)22-18-10-6-5-7-11-18/h5-13,22H,3-4,14-17H2,1-2H3