N-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]-4-(4-methylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]-4-(4-methylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]-4-(4-methylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]-4-[(4-methyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]methyl]-4-(4-methylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[4-(2-imidazolin-2-ylamino)benzyl]-4-(4-methylpiperazino)sulfonyl-benzamide Formula: C22H28N6O3S MolecularWeight: 456.56112

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)NC4=NCCN4

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)NC4=NCCN4

InChI

InChI=1S/C22H28N6O3S/c1-27-12-14-28(15-13-27)32(30,31)20-8-4-18(5-9-20)21(29)25-16-17-2-6-19(7-3-17)26-22-23-10-11-24-22/h2-9H,10-16H2,1H3,(H,25,29)(H2,23,24,26)