(1-methyl-4-morpholin-4-ylsulfonyl-pyrrol-2-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (1-methyl-4-morpholin-4-ylsulfonyl-pyrrol-2-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-(1-methyl-4-morpholinosulfonyl-pyrrol-2-yl)methanone CAS Name: [1-methyl-4-(4-morpholinylsulfonyl)-2-pyrrolyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(1-methyl-4-morpholin-4-ylsulfonylpyrrol-2-yl)methanone Traditional Name: (4-benzylpiperazino)-(1-methyl-4-morpholinosulfonyl-pyrrol-2-yl)methanone Formula: C21H28N4O4S MolecularWeight: 432.53642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N2CCN(CC2)CC3=CC=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)N2CCN(CC2)CC3=CC=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H28N4O4S/c1-22-17-19(30(27,28)25-11-13-29-14-12-25)15-20(22)21(26)24-9-7-23(8-10-24)16-18-5-3-2-4-6-18/h2-6,15,17H,7-14,16H2,1H3