6-azanyl-5-[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]ethanoyl]-1-propyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]ethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(4-indan-5-ylsulfonylpiperazin-1-yl)acetyl]-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-1-oxoethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]acetyl]-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-(4-indan-5-ylsulfonylpiperazino)acetyl]-1-propyl-pyrimidine-2,4-quinone Formula: C22H29N5O5S MolecularWeight: 475.56116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3)N

InChI

InChI=1S/C22H29N5O5S/c1-2-8-27-20(23)19(21(29)24-22(27)30)18(28)14-25-9-11-26(12-10-25)33(31,32)17-7-6-15-4-3-5-16(15)13-17/h6-7,13H,2-5,8-12,14,23H2,1H3,(H,24,29,30)