N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-(4-methylpiperazin-1-yl)sulfonyl-N-propyl-benzamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-(4-methylpiperazin-1-yl)sulfonyl-N-propyl-benzamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-3-(4-methylpiperazin-1-yl)sulfonyl-N-propyl-benzamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-3-[(4-methyl-1-piperazinyl)sulfonyl]-N-propylbenzamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-3-(4-methylpiperazin-1-yl)sulfonyl-N-propylbenzamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-3-(4-methylpiperazino)sulfonyl-N-propyl-benzamide Formula: C26H32N6O5S MolecularWeight: 540.63448

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C

Isomeric SMILES

CCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C

InChI

InChI=1S/C26H32N6O5S/c1-3-12-31(22-23(27)32(26(35)28-24(22)33)18-19-8-5-4-6-9-19)25(34)20-10-7-11-21(17-20)38(36,37)30-15-13-29(2)14-16-30/h4-11,17H,3,12-16,18,27H2,1-2H3,(H,28,33,35)