[5-chloranyl-2-(furan-2-ylmethylamino)pyrimidin-4-yl]-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [5-chloranyl-2-(furan-2-ylmethylamino)pyrimidin-4-yl]-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [5-chloro-2-(2-furylmethylamino)pyrimidin-4-yl]-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [5-chloro-2-(2-furanylmethylamino)-4-pyrimidinyl]-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [5-chloro-2-(furan-2-ylmethylamino)pyrimidin-4-yl]-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [5-chloro-2-(2-furfurylamino)pyrimidin-4-yl]-[4-(4-methoxyphenyl)sulfonylpiperazino]methanone Formula: C21H22ClN5O5S MolecularWeight: 491.94788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC(=NC=C3Cl)NCC4=CC=CO4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC(=NC=C3Cl)NCC4=CC=CO4

InChI

InChI=1S/C21H22ClN5O5S/c1-31-15-4-6-17(7-5-15)33(29,30)27-10-8-26(9-11-27)20(28)19-18(22)14-24-21(25-19)23-13-16-3-2-12-32-16/h2-7,12,14H,8-11,13H2,1H3,(H,23,24,25)